From bdde5dd8865bdfde6e6703542a90956d8615b4a3 Mon Sep 17 00:00:00 2001 From: Unknown Date: Wed, 16 Jun 2021 18:18:09 +0200 Subject: [PATCH] some bugfixes and documentation --- docs/make.jl | 1 + .../job/Job2/Si.pdos_atm#1(Si)_wfc#1(s) | 107 + .../job/Job2/Si.pdos_atm#1(Si)_wfc#2(p) | 107 + .../job/Job2/Si.pdos_atm#2(Si)_wfc#1(s) | 107 + .../job/Job2/Si.pdos_atm#2(Si)_wfc#2(p) | 107 + .../job/Job2/Si.pdos_atm#3(Si)_wfc#1(s) | 107 + .../job/Job2/Si.pdos_atm#3(Si)_wfc#2(p) | 107 + .../job/Job2/Si.pdos_atm#4(Si)_wfc#1(s) | 107 + .../job/Job2/Si.pdos_atm#4(Si)_wfc#2(p) | 107 + .../job/Job2/Si.pdos_atm#5(Si)_wfc#1(s) | 107 + .../job/Job2/Si.pdos_atm#5(Si)_wfc#2(p) | 107 + .../job/Job2/Si.pdos_atm#6(Si)_wfc#1(s) | 107 + .../job/Job2/Si.pdos_atm#6(Si)_wfc#2(p) | 107 + .../job/Job2/Si.pdos_atm#7(Si)_wfc#1(s) | 107 + .../job/Job2/Si.pdos_atm#7(Si)_wfc#2(p) | 107 + .../job/Job2/Si.pdos_atm#8(Si)_wfc#1(s) | 107 + .../job/Job2/Si.pdos_atm#8(Si)_wfc#2(p) | 107 + docs/src/assets/job/Job2/Si.pdos_tot | 107 + docs/src/assets/job/Job2/bands.in | 52 + docs/src/assets/job/Job2/bands.out | 2216 ++ docs/src/assets/job/Job2/job.tt | 7 + docs/src/assets/job/Job2/nscf.in | 256 + docs/src/assets/job/Job2/nscf.out | 3041 ++ docs/src/assets/job/Job2/projwfc.in | 229 + docs/src/assets/job/Job2/projwfc.out | 29747 ++++++++++++++++ docs/src/assets/job/Job2/scf.in | 39 + docs/src/assets/job/Job2/scf.out | 291 + docs/src/guide/jobs.md | 1 + src/input.jl | 3 + src/job.jl | 6 +- src/qe/fileio.jl | 4 +- src/qe/input.jl | 2 +- test/job_control_tests.jl | 2 - 33 files changed, 37709 insertions(+), 7 deletions(-) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#1(Si)_wfc#1(s) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#1(Si)_wfc#2(p) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#2(Si)_wfc#1(s) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#2(Si)_wfc#2(p) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#3(Si)_wfc#1(s) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#3(Si)_wfc#2(p) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#4(Si)_wfc#1(s) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#4(Si)_wfc#2(p) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#5(Si)_wfc#1(s) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#5(Si)_wfc#2(p) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#6(Si)_wfc#1(s) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#6(Si)_wfc#2(p) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#7(Si)_wfc#1(s) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#7(Si)_wfc#2(p) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#8(Si)_wfc#1(s) create mode 100644 docs/src/assets/job/Job2/Si.pdos_atm#8(Si)_wfc#2(p) create mode 100644 docs/src/assets/job/Job2/Si.pdos_tot create mode 100644 docs/src/assets/job/Job2/bands.in create mode 100644 docs/src/assets/job/Job2/bands.out create mode 100644 docs/src/assets/job/Job2/job.tt create mode 100644 docs/src/assets/job/Job2/nscf.in create mode 100644 docs/src/assets/job/Job2/nscf.out create mode 100644 docs/src/assets/job/Job2/projwfc.in create mode 100644 docs/src/assets/job/Job2/projwfc.out create mode 100644 docs/src/assets/job/Job2/scf.in create mode 100644 docs/src/assets/job/Job2/scf.out create mode 100644 docs/src/guide/jobs.md diff --git a/docs/make.jl b/docs/make.jl index d8698764..84dc9527 100644 --- a/docs/make.jl +++ b/docs/make.jl @@ -99,6 +99,7 @@ makedocs( "Advanced Tutorial" => "guide/advanced_tutorial.md" ], "Usage" => Any[ + "guide/jobs.md", "guide/pseudo.md", ], # "Examples" => EXAMPLES, diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#1(Si)_wfc#1(s) b/docs/src/assets/job/Job2/Si.pdos_atm#1(Si)_wfc#1(s) new file mode 100644 index 00000000..8e877d10 --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#1(Si)_wfc#1(s) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) + -3.973 0.133E+00 0.133E+00 + -3.873 0.211E+00 0.211E+00 + -3.773 0.309E+00 0.309E+00 + -3.673 0.260E+00 0.260E+00 + -3.573 0.308E+00 0.308E+00 + -3.473 0.373E+00 0.373E+00 + -3.373 0.215E+00 0.215E+00 + -3.273 0.213E+00 0.213E+00 + -3.173 0.268E+00 0.268E+00 + -3.073 0.319E+00 0.319E+00 + -2.973 0.948E-01 0.948E-01 + -2.873 0.144E+00 0.144E+00 + -2.773 0.317E+00 0.317E+00 + -2.673 0.340E+00 0.340E+00 + -2.573 0.424E+00 0.424E+00 + -2.473 0.165E+00 0.165E+00 + -2.373 0.659E-01 0.659E-01 + -2.273 0.996E-01 0.996E-01 + -2.173 0.327E-01 0.327E-01 + -2.073 0.723E-01 0.723E-01 + -1.973 0.920E-01 0.920E-01 + -1.873 0.468E-01 0.468E-01 + -1.773 0.640E-01 0.640E-01 + -1.673 0.126E+00 0.126E+00 + -1.573 0.195E+00 0.195E+00 + -1.473 0.141E+00 0.141E+00 + -1.373 0.550E-01 0.550E-01 + -1.273 0.130E-01 0.130E-01 + -1.173 0.544E-01 0.544E-01 + -1.073 0.771E-01 0.771E-01 + -0.973 0.178E-01 0.178E-01 + -0.873 0.460E-01 0.460E-01 + -0.773 0.200E+00 0.200E+00 + -0.673 0.325E+00 0.325E+00 + -0.573 0.357E+00 0.357E+00 + -0.473 0.361E+00 0.361E+00 + -0.373 0.315E+00 0.315E+00 + -0.273 0.105E+00 0.105E+00 + -0.173 0.344E-01 0.344E-01 + -0.073 0.969E-01 0.969E-01 + 0.027 0.159E+00 0.159E+00 + 0.127 0.204E+00 0.204E+00 + 0.227 0.595E-01 0.595E-01 + 0.327 0.528E-02 0.528E-02 + 0.427 0.387E-01 0.387E-01 + 0.527 0.830E-01 0.830E-01 + 0.627 0.952E-01 0.952E-01 + 0.727 0.116E+00 0.116E+00 + 0.827 0.133E+00 0.133E+00 + 0.927 0.145E+00 0.145E+00 + 1.027 0.702E-01 0.702E-01 + 1.127 0.258E-01 0.258E-01 + 1.227 0.108E-01 0.108E-01 + 1.327 0.109E-01 0.109E-01 + 1.427 0.562E-01 0.562E-01 + 1.527 0.449E-01 0.449E-01 + 1.627 0.487E-01 0.487E-01 + 1.727 0.106E+00 0.106E+00 + 1.827 0.391E-01 0.391E-01 + 1.927 0.108E-01 0.108E-01 + 2.027 0.141E-01 0.141E-01 + 2.127 0.492E-01 0.492E-01 + 2.227 0.931E-01 0.931E-01 + 2.327 0.536E-01 0.536E-01 + 2.427 0.526E-01 0.526E-01 + 2.527 0.673E-01 0.673E-01 + 2.627 0.600E-01 0.600E-01 + 2.727 0.559E-01 0.559E-01 + 2.827 0.344E-01 0.344E-01 + 2.927 0.461E-01 0.461E-01 + 3.027 0.449E-01 0.449E-01 + 3.127 0.344E-01 0.344E-01 + 3.227 0.176E-01 0.176E-01 + 3.327 0.456E-01 0.456E-01 + 3.427 0.711E-01 0.711E-01 + 3.527 0.447E-01 0.447E-01 + 3.627 0.372E-01 0.372E-01 + 3.727 0.552E-01 0.552E-01 + 3.827 0.265E-01 0.265E-01 + 3.927 0.509E-02 0.509E-02 + 4.027 0.127E-01 0.127E-01 + 4.127 0.364E-01 0.364E-01 + 4.227 0.285E-01 0.285E-01 + 4.327 0.143E-01 0.143E-01 + 4.427 0.210E-01 0.210E-01 + 4.527 0.432E-01 0.432E-01 + 4.627 0.265E-01 0.265E-01 + 4.727 0.436E-02 0.436E-02 + 4.827 0.690E-02 0.690E-02 + 4.927 0.475E-02 0.475E-02 + 5.027 0.709E-03 0.709E-03 + 5.127 0.455E-02 0.455E-02 + 5.227 0.141E-01 0.141E-01 + 5.327 0.831E-02 0.831E-02 + 5.427 0.101E-01 0.101E-01 + 5.527 0.783E-02 0.783E-02 + 5.627 0.884E-03 0.884E-03 + 5.727 0.138E-04 0.138E-04 + 5.827 0.300E-07 0.300E-07 + 5.927 0.167E-09 0.167E-09 + 6.027 0.652E-09 0.652E-09 + 6.127 0.559E-09 0.559E-09 + 6.227 0.178E-09 0.178E-09 + 6.327 0.184E-10 0.184E-10 + 6.427 0.305E-12 0.305E-12 + 6.527 0.699E-15 0.699E-15 diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#1(Si)_wfc#2(p) b/docs/src/assets/job/Job2/Si.pdos_atm#1(Si)_wfc#2(p) new file mode 100644 index 00000000..26715660 --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#1(Si)_wfc#2(p) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) pdos(E) pdos(E) + -3.973 0.543E-01 0.181E-01 0.181E-01 0.181E-01 + -3.873 0.890E-01 0.297E-01 0.297E-01 0.297E-01 + -3.773 0.135E+00 0.451E-01 0.451E-01 0.451E-01 + -3.673 0.112E+00 0.375E-01 0.375E-01 0.375E-01 + -3.573 0.134E+00 0.445E-01 0.445E-01 0.445E-01 + -3.473 0.170E+00 0.566E-01 0.566E-01 0.566E-01 + -3.373 0.918E-01 0.306E-01 0.306E-01 0.306E-01 + -3.273 0.744E-01 0.248E-01 0.248E-01 0.248E-01 + -3.173 0.919E-01 0.306E-01 0.306E-01 0.306E-01 + -3.073 0.115E+00 0.384E-01 0.384E-01 0.384E-01 + -2.973 0.367E-01 0.122E-01 0.122E-01 0.122E-01 + -2.873 0.753E-01 0.251E-01 0.251E-01 0.251E-01 + -2.773 0.170E+00 0.565E-01 0.565E-01 0.565E-01 + -2.673 0.175E+00 0.585E-01 0.585E-01 0.585E-01 + -2.573 0.204E+00 0.682E-01 0.682E-01 0.682E-01 + -2.473 0.727E-01 0.242E-01 0.242E-01 0.242E-01 + -2.373 0.246E-01 0.822E-02 0.822E-02 0.822E-02 + -2.273 0.362E-01 0.121E-01 0.121E-01 0.121E-01 + -2.173 0.129E-01 0.430E-02 0.430E-02 0.430E-02 + -2.073 0.364E-01 0.121E-01 0.121E-01 0.121E-01 + -1.973 0.468E-01 0.156E-01 0.156E-01 0.156E-01 + -1.873 0.273E-01 0.910E-02 0.910E-02 0.910E-02 + -1.773 0.395E-01 0.132E-01 0.132E-01 0.132E-01 + -1.673 0.730E-01 0.243E-01 0.243E-01 0.243E-01 + -1.573 0.102E+00 0.342E-01 0.342E-01 0.342E-01 + -1.473 0.742E-01 0.247E-01 0.247E-01 0.247E-01 + -1.373 0.374E-01 0.125E-01 0.125E-01 0.125E-01 + -1.273 0.102E-01 0.341E-02 0.341E-02 0.341E-02 + -1.173 0.446E-01 0.149E-01 0.149E-01 0.149E-01 + -1.073 0.632E-01 0.211E-01 0.211E-01 0.211E-01 + -0.973 0.176E-01 0.588E-02 0.588E-02 0.588E-02 + -0.873 0.615E-01 0.205E-01 0.205E-01 0.205E-01 + -0.773 0.259E+00 0.863E-01 0.863E-01 0.863E-01 + -0.673 0.423E+00 0.141E+00 0.141E+00 0.141E+00 + -0.573 0.452E+00 0.151E+00 0.151E+00 0.151E+00 + -0.473 0.439E+00 0.146E+00 0.146E+00 0.146E+00 + -0.373 0.347E+00 0.116E+00 0.116E+00 0.116E+00 + -0.273 0.943E-01 0.314E-01 0.314E-01 0.314E-01 + -0.173 0.383E-01 0.128E-01 0.128E-01 0.128E-01 + -0.073 0.139E+00 0.462E-01 0.462E-01 0.462E-01 + 0.027 0.277E+00 0.922E-01 0.922E-01 0.922E-01 + 0.127 0.328E+00 0.109E+00 0.109E+00 0.109E+00 + 0.227 0.918E-01 0.306E-01 0.306E-01 0.306E-01 + 0.327 0.681E-02 0.227E-02 0.227E-02 0.227E-02 + 0.427 0.407E-01 0.136E-01 0.136E-01 0.136E-01 + 0.527 0.879E-01 0.293E-01 0.293E-01 0.293E-01 + 0.627 0.105E+00 0.351E-01 0.351E-01 0.351E-01 + 0.727 0.151E+00 0.504E-01 0.504E-01 0.504E-01 + 0.827 0.240E+00 0.799E-01 0.799E-01 0.799E-01 + 0.927 0.215E+00 0.715E-01 0.715E-01 0.715E-01 + 1.027 0.732E-01 0.244E-01 0.244E-01 0.244E-01 + 1.127 0.189E-01 0.629E-02 0.629E-02 0.629E-02 + 1.227 0.712E-02 0.237E-02 0.237E-02 0.237E-02 + 1.327 0.125E-01 0.418E-02 0.418E-02 0.418E-02 + 1.427 0.670E-01 0.223E-01 0.223E-01 0.223E-01 + 1.527 0.589E-01 0.196E-01 0.196E-01 0.196E-01 + 1.627 0.122E+00 0.407E-01 0.407E-01 0.407E-01 + 1.727 0.273E+00 0.909E-01 0.909E-01 0.909E-01 + 1.827 0.290E+00 0.966E-01 0.966E-01 0.966E-01 + 1.927 0.304E+00 0.101E+00 0.101E+00 0.101E+00 + 2.027 0.214E+00 0.714E-01 0.714E-01 0.714E-01 + 2.127 0.473E+00 0.158E+00 0.158E+00 0.158E+00 + 2.227 0.592E+00 0.197E+00 0.197E+00 0.197E+00 + 2.327 0.428E+00 0.143E+00 0.143E+00 0.143E+00 + 2.427 0.493E+00 0.164E+00 0.164E+00 0.164E+00 + 2.527 0.601E+00 0.200E+00 0.200E+00 0.200E+00 + 2.627 0.301E+00 0.100E+00 0.100E+00 0.100E+00 + 2.727 0.193E+00 0.643E-01 0.643E-01 0.643E-01 + 2.827 0.239E+00 0.798E-01 0.798E-01 0.798E-01 + 2.927 0.686E+00 0.229E+00 0.229E+00 0.229E+00 + 3.027 0.856E+00 0.285E+00 0.285E+00 0.285E+00 + 3.127 0.517E+00 0.172E+00 0.172E+00 0.172E+00 + 3.227 0.436E+00 0.145E+00 0.145E+00 0.145E+00 + 3.327 0.697E+00 0.232E+00 0.232E+00 0.232E+00 + 3.427 0.751E+00 0.250E+00 0.250E+00 0.250E+00 + 3.527 0.707E+00 0.236E+00 0.236E+00 0.236E+00 + 3.627 0.637E+00 0.212E+00 0.212E+00 0.212E+00 + 3.727 0.792E+00 0.264E+00 0.264E+00 0.264E+00 + 3.827 0.547E+00 0.182E+00 0.182E+00 0.182E+00 + 3.927 0.466E+00 0.155E+00 0.155E+00 0.155E+00 + 4.027 0.758E+00 0.253E+00 0.253E+00 0.253E+00 + 4.127 0.857E+00 0.286E+00 0.286E+00 0.286E+00 + 4.227 0.556E+00 0.185E+00 0.185E+00 0.185E+00 + 4.327 0.427E+00 0.142E+00 0.142E+00 0.142E+00 + 4.427 0.717E+00 0.239E+00 0.239E+00 0.239E+00 + 4.527 0.786E+00 0.262E+00 0.262E+00 0.262E+00 + 4.627 0.322E+00 0.107E+00 0.107E+00 0.107E+00 + 4.727 0.312E+00 0.104E+00 0.104E+00 0.104E+00 + 4.827 0.696E+00 0.232E+00 0.232E+00 0.232E+00 + 4.927 0.614E+00 0.205E+00 0.205E+00 0.205E+00 + 5.027 0.320E+00 0.107E+00 0.107E+00 0.107E+00 + 5.127 0.256E+00 0.854E-01 0.854E-01 0.854E-01 + 5.227 0.278E+00 0.928E-01 0.928E-01 0.928E-01 + 5.327 0.171E+00 0.571E-01 0.571E-01 0.571E-01 + 5.427 0.295E+00 0.982E-01 0.982E-01 0.982E-01 + 5.527 0.305E+00 0.102E+00 0.102E+00 0.102E+00 + 5.627 0.193E+00 0.642E-01 0.642E-01 0.642E-01 + 5.727 0.187E+00 0.624E-01 0.624E-01 0.624E-01 + 5.827 0.592E-01 0.197E-01 0.197E-01 0.197E-01 + 5.927 0.168E-01 0.559E-02 0.559E-02 0.559E-02 + 6.027 0.678E-01 0.226E-01 0.226E-01 0.226E-01 + 6.127 0.568E-01 0.189E-01 0.189E-01 0.189E-01 + 6.227 0.173E-01 0.576E-02 0.576E-02 0.576E-02 + 6.327 0.175E-02 0.584E-03 0.584E-03 0.584E-03 + 6.427 0.291E-04 0.969E-05 0.969E-05 0.969E-05 + 6.527 0.666E-07 0.222E-07 0.222E-07 0.222E-07 diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#2(Si)_wfc#1(s) b/docs/src/assets/job/Job2/Si.pdos_atm#2(Si)_wfc#1(s) new file mode 100644 index 00000000..7c55f19a --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#2(Si)_wfc#1(s) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) + -3.973 0.134E+00 0.134E+00 + -3.873 0.212E+00 0.212E+00 + -3.773 0.311E+00 0.311E+00 + -3.673 0.260E+00 0.260E+00 + -3.573 0.309E+00 0.309E+00 + -3.473 0.372E+00 0.372E+00 + -3.373 0.215E+00 0.215E+00 + -3.273 0.213E+00 0.213E+00 + -3.173 0.268E+00 0.268E+00 + -3.073 0.318E+00 0.318E+00 + -2.973 0.936E-01 0.936E-01 + -2.873 0.145E+00 0.145E+00 + -2.773 0.317E+00 0.317E+00 + -2.673 0.340E+00 0.340E+00 + -2.573 0.424E+00 0.424E+00 + -2.473 0.164E+00 0.164E+00 + -2.373 0.662E-01 0.662E-01 + -2.273 0.994E-01 0.994E-01 + -2.173 0.323E-01 0.323E-01 + -2.073 0.722E-01 0.722E-01 + -1.973 0.919E-01 0.919E-01 + -1.873 0.468E-01 0.468E-01 + -1.773 0.645E-01 0.645E-01 + -1.673 0.128E+00 0.128E+00 + -1.573 0.195E+00 0.195E+00 + -1.473 0.139E+00 0.139E+00 + -1.373 0.546E-01 0.546E-01 + -1.273 0.130E-01 0.130E-01 + -1.173 0.545E-01 0.545E-01 + -1.073 0.771E-01 0.771E-01 + -0.973 0.178E-01 0.178E-01 + -0.873 0.461E-01 0.461E-01 + -0.773 0.200E+00 0.200E+00 + -0.673 0.325E+00 0.325E+00 + -0.573 0.357E+00 0.357E+00 + -0.473 0.361E+00 0.361E+00 + -0.373 0.315E+00 0.315E+00 + -0.273 0.104E+00 0.104E+00 + -0.173 0.344E-01 0.344E-01 + -0.073 0.970E-01 0.970E-01 + 0.027 0.159E+00 0.159E+00 + 0.127 0.204E+00 0.204E+00 + 0.227 0.592E-01 0.592E-01 + 0.327 0.527E-02 0.527E-02 + 0.427 0.388E-01 0.388E-01 + 0.527 0.830E-01 0.830E-01 + 0.627 0.951E-01 0.951E-01 + 0.727 0.116E+00 0.116E+00 + 0.827 0.133E+00 0.133E+00 + 0.927 0.145E+00 0.145E+00 + 1.027 0.700E-01 0.700E-01 + 1.127 0.258E-01 0.258E-01 + 1.227 0.108E-01 0.108E-01 + 1.327 0.109E-01 0.109E-01 + 1.427 0.562E-01 0.562E-01 + 1.527 0.449E-01 0.449E-01 + 1.627 0.487E-01 0.487E-01 + 1.727 0.105E+00 0.105E+00 + 1.827 0.390E-01 0.390E-01 + 1.927 0.108E-01 0.108E-01 + 2.027 0.141E-01 0.141E-01 + 2.127 0.492E-01 0.492E-01 + 2.227 0.930E-01 0.930E-01 + 2.327 0.538E-01 0.538E-01 + 2.427 0.529E-01 0.529E-01 + 2.527 0.672E-01 0.672E-01 + 2.627 0.597E-01 0.597E-01 + 2.727 0.559E-01 0.559E-01 + 2.827 0.344E-01 0.344E-01 + 2.927 0.461E-01 0.461E-01 + 3.027 0.450E-01 0.450E-01 + 3.127 0.342E-01 0.342E-01 + 3.227 0.177E-01 0.177E-01 + 3.327 0.458E-01 0.458E-01 + 3.427 0.709E-01 0.709E-01 + 3.527 0.447E-01 0.447E-01 + 3.627 0.371E-01 0.371E-01 + 3.727 0.551E-01 0.551E-01 + 3.827 0.264E-01 0.264E-01 + 3.927 0.510E-02 0.510E-02 + 4.027 0.127E-01 0.127E-01 + 4.127 0.364E-01 0.364E-01 + 4.227 0.287E-01 0.287E-01 + 4.327 0.142E-01 0.142E-01 + 4.427 0.209E-01 0.209E-01 + 4.527 0.432E-01 0.432E-01 + 4.627 0.265E-01 0.265E-01 + 4.727 0.437E-02 0.437E-02 + 4.827 0.691E-02 0.691E-02 + 4.927 0.474E-02 0.474E-02 + 5.027 0.706E-03 0.706E-03 + 5.127 0.455E-02 0.455E-02 + 5.227 0.141E-01 0.141E-01 + 5.327 0.830E-02 0.830E-02 + 5.427 0.101E-01 0.101E-01 + 5.527 0.783E-02 0.783E-02 + 5.627 0.884E-03 0.884E-03 + 5.727 0.138E-04 0.138E-04 + 5.827 0.303E-07 0.303E-07 + 5.927 0.504E-09 0.504E-09 + 6.027 0.221E-08 0.221E-08 + 6.127 0.168E-08 0.168E-08 + 6.227 0.392E-09 0.392E-09 + 6.327 0.355E-10 0.355E-10 + 6.427 0.580E-12 0.580E-12 + 6.527 0.133E-14 0.133E-14 diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#2(Si)_wfc#2(p) b/docs/src/assets/job/Job2/Si.pdos_atm#2(Si)_wfc#2(p) new file mode 100644 index 00000000..b23eaee6 --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#2(Si)_wfc#2(p) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) pdos(E) pdos(E) + -3.973 0.489E-01 0.160E-01 0.170E-01 0.160E-01 + -3.873 0.852E-01 0.280E-01 0.292E-01 0.280E-01 + -3.773 0.131E+00 0.429E-01 0.450E-01 0.429E-01 + -3.673 0.104E+00 0.343E-01 0.351E-01 0.343E-01 + -3.573 0.118E+00 0.405E-01 0.368E-01 0.405E-01 + -3.473 0.151E+00 0.524E-01 0.459E-01 0.524E-01 + -3.373 0.835E-01 0.290E-01 0.255E-01 0.290E-01 + -3.273 0.767E-01 0.264E-01 0.239E-01 0.264E-01 + -3.173 0.110E+00 0.379E-01 0.340E-01 0.379E-01 + -3.073 0.141E+00 0.487E-01 0.434E-01 0.487E-01 + -2.973 0.426E-01 0.146E-01 0.133E-01 0.146E-01 + -2.873 0.699E-01 0.233E-01 0.233E-01 0.233E-01 + -2.773 0.154E+00 0.511E-01 0.519E-01 0.511E-01 + -2.673 0.170E+00 0.565E-01 0.569E-01 0.565E-01 + -2.573 0.210E+00 0.704E-01 0.696E-01 0.704E-01 + -2.473 0.791E-01 0.266E-01 0.258E-01 0.266E-01 + -2.373 0.338E-01 0.117E-01 0.104E-01 0.117E-01 + -2.273 0.517E-01 0.180E-01 0.158E-01 0.180E-01 + -2.173 0.167E-01 0.576E-02 0.522E-02 0.576E-02 + -2.073 0.365E-01 0.122E-01 0.122E-01 0.122E-01 + -1.973 0.467E-01 0.156E-01 0.156E-01 0.156E-01 + -1.873 0.258E-01 0.850E-02 0.877E-02 0.850E-02 + -1.773 0.373E-01 0.123E-01 0.127E-01 0.123E-01 + -1.673 0.729E-01 0.243E-01 0.243E-01 0.243E-01 + -1.573 0.105E+00 0.352E-01 0.349E-01 0.352E-01 + -1.473 0.787E-01 0.264E-01 0.259E-01 0.264E-01 + -1.373 0.384E-01 0.128E-01 0.127E-01 0.128E-01 + -1.273 0.103E-01 0.343E-02 0.342E-02 0.343E-02 + -1.173 0.446E-01 0.149E-01 0.149E-01 0.149E-01 + -1.073 0.633E-01 0.211E-01 0.211E-01 0.211E-01 + -0.973 0.183E-01 0.604E-02 0.624E-02 0.604E-02 + -0.873 0.638E-01 0.209E-01 0.221E-01 0.209E-01 + -0.773 0.259E+00 0.855E-01 0.879E-01 0.855E-01 + -0.673 0.413E+00 0.137E+00 0.138E+00 0.137E+00 + -0.573 0.452E+00 0.150E+00 0.152E+00 0.150E+00 + -0.473 0.459E+00 0.153E+00 0.154E+00 0.153E+00 + -0.373 0.358E+00 0.119E+00 0.119E+00 0.119E+00 + -0.273 0.950E-01 0.318E-01 0.313E-01 0.318E-01 + -0.173 0.330E-01 0.111E-01 0.109E-01 0.111E-01 + -0.073 0.118E+00 0.398E-01 0.381E-01 0.398E-01 + 0.027 0.253E+00 0.873E-01 0.780E-01 0.873E-01 + 0.127 0.322E+00 0.112E+00 0.987E-01 0.112E+00 + 0.227 0.926E-01 0.320E-01 0.285E-01 0.320E-01 + 0.327 0.682E-02 0.238E-02 0.205E-02 0.238E-02 + 0.427 0.399E-01 0.142E-01 0.115E-01 0.142E-01 + 0.527 0.870E-01 0.307E-01 0.256E-01 0.307E-01 + 0.627 0.112E+00 0.369E-01 0.382E-01 0.369E-01 + 0.727 0.155E+00 0.499E-01 0.548E-01 0.499E-01 + 0.827 0.222E+00 0.744E-01 0.736E-01 0.744E-01 + 0.927 0.204E+00 0.687E-01 0.663E-01 0.687E-01 + 1.027 0.722E-01 0.242E-01 0.239E-01 0.242E-01 + 1.127 0.189E-01 0.629E-02 0.630E-02 0.629E-02 + 1.227 0.719E-02 0.239E-02 0.240E-02 0.239E-02 + 1.327 0.150E-01 0.499E-02 0.500E-02 0.499E-02 + 1.427 0.805E-01 0.268E-01 0.269E-01 0.268E-01 + 1.527 0.695E-01 0.230E-01 0.234E-01 0.230E-01 + 1.627 0.128E+00 0.410E-01 0.459E-01 0.410E-01 + 1.727 0.280E+00 0.898E-01 0.101E+00 0.898E-01 + 1.827 0.303E+00 0.996E-01 0.103E+00 0.996E-01 + 1.927 0.347E+00 0.116E+00 0.115E+00 0.116E+00 + 2.027 0.260E+00 0.869E-01 0.859E-01 0.869E-01 + 2.127 0.504E+00 0.168E+00 0.168E+00 0.168E+00 + 2.227 0.617E+00 0.206E+00 0.204E+00 0.206E+00 + 2.327 0.458E+00 0.153E+00 0.152E+00 0.153E+00 + 2.427 0.547E+00 0.181E+00 0.184E+00 0.181E+00 + 2.527 0.701E+00 0.229E+00 0.243E+00 0.229E+00 + 2.627 0.306E+00 0.996E-01 0.107E+00 0.996E-01 + 2.727 0.147E+00 0.497E-01 0.478E-01 0.497E-01 + 2.827 0.236E+00 0.819E-01 0.721E-01 0.819E-01 + 2.927 0.693E+00 0.237E+00 0.219E+00 0.237E+00 + 3.027 0.837E+00 0.279E+00 0.279E+00 0.279E+00 + 3.127 0.518E+00 0.169E+00 0.180E+00 0.169E+00 + 3.227 0.437E+00 0.143E+00 0.150E+00 0.143E+00 + 3.327 0.699E+00 0.232E+00 0.236E+00 0.232E+00 + 3.427 0.740E+00 0.243E+00 0.255E+00 0.243E+00 + 3.527 0.691E+00 0.222E+00 0.248E+00 0.222E+00 + 3.627 0.555E+00 0.182E+00 0.192E+00 0.182E+00 + 3.727 0.721E+00 0.244E+00 0.233E+00 0.244E+00 + 3.827 0.588E+00 0.199E+00 0.190E+00 0.199E+00 + 3.927 0.448E+00 0.151E+00 0.147E+00 0.151E+00 + 4.027 0.664E+00 0.218E+00 0.228E+00 0.218E+00 + 4.127 0.820E+00 0.269E+00 0.281E+00 0.269E+00 + 4.227 0.614E+00 0.201E+00 0.211E+00 0.201E+00 + 4.327 0.437E+00 0.143E+00 0.150E+00 0.143E+00 + 4.427 0.634E+00 0.210E+00 0.213E+00 0.210E+00 + 4.527 0.726E+00 0.244E+00 0.238E+00 0.244E+00 + 4.627 0.320E+00 0.108E+00 0.104E+00 0.108E+00 + 4.727 0.307E+00 0.101E+00 0.105E+00 0.101E+00 + 4.827 0.810E+00 0.270E+00 0.269E+00 0.270E+00 + 4.927 0.755E+00 0.251E+00 0.254E+00 0.251E+00 + 5.027 0.353E+00 0.117E+00 0.120E+00 0.117E+00 + 5.127 0.237E+00 0.784E-01 0.806E-01 0.784E-01 + 5.227 0.263E+00 0.873E-01 0.886E-01 0.873E-01 + 5.327 0.170E+00 0.565E-01 0.566E-01 0.565E-01 + 5.427 0.293E+00 0.976E-01 0.976E-01 0.976E-01 + 5.527 0.285E+00 0.949E-01 0.956E-01 0.949E-01 + 5.627 0.160E+00 0.530E-01 0.543E-01 0.530E-01 + 5.727 0.179E+00 0.597E-01 0.600E-01 0.597E-01 + 5.827 0.589E-01 0.196E-01 0.196E-01 0.196E-01 + 5.927 0.167E-01 0.558E-02 0.558E-02 0.558E-02 + 6.027 0.675E-01 0.225E-01 0.225E-01 0.225E-01 + 6.127 0.555E-01 0.186E-01 0.183E-01 0.186E-01 + 6.227 0.161E-01 0.546E-02 0.517E-02 0.546E-02 + 6.327 0.160E-02 0.547E-03 0.510E-03 0.547E-03 + 6.427 0.265E-04 0.906E-05 0.844E-05 0.906E-05 + 6.527 0.608E-07 0.207E-07 0.193E-07 0.207E-07 diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#3(Si)_wfc#1(s) b/docs/src/assets/job/Job2/Si.pdos_atm#3(Si)_wfc#1(s) new file mode 100644 index 00000000..03f8b13b --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#3(Si)_wfc#1(s) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) + -3.973 0.134E+00 0.134E+00 + -3.873 0.212E+00 0.212E+00 + -3.773 0.311E+00 0.311E+00 + -3.673 0.260E+00 0.260E+00 + -3.573 0.309E+00 0.309E+00 + -3.473 0.373E+00 0.373E+00 + -3.373 0.215E+00 0.215E+00 + -3.273 0.213E+00 0.213E+00 + -3.173 0.268E+00 0.268E+00 + -3.073 0.318E+00 0.318E+00 + -2.973 0.940E-01 0.940E-01 + -2.873 0.145E+00 0.145E+00 + -2.773 0.318E+00 0.318E+00 + -2.673 0.341E+00 0.341E+00 + -2.573 0.424E+00 0.424E+00 + -2.473 0.164E+00 0.164E+00 + -2.373 0.662E-01 0.662E-01 + -2.273 0.995E-01 0.995E-01 + -2.173 0.324E-01 0.324E-01 + -2.073 0.723E-01 0.723E-01 + -1.973 0.921E-01 0.921E-01 + -1.873 0.469E-01 0.469E-01 + -1.773 0.650E-01 0.650E-01 + -1.673 0.128E+00 0.128E+00 + -1.573 0.195E+00 0.195E+00 + -1.473 0.138E+00 0.138E+00 + -1.373 0.542E-01 0.542E-01 + -1.273 0.130E-01 0.130E-01 + -1.173 0.544E-01 0.544E-01 + -1.073 0.770E-01 0.770E-01 + -0.973 0.178E-01 0.178E-01 + -0.873 0.461E-01 0.461E-01 + -0.773 0.200E+00 0.200E+00 + -0.673 0.324E+00 0.324E+00 + -0.573 0.357E+00 0.357E+00 + -0.473 0.361E+00 0.361E+00 + -0.373 0.315E+00 0.315E+00 + -0.273 0.105E+00 0.105E+00 + -0.173 0.344E-01 0.344E-01 + -0.073 0.970E-01 0.970E-01 + 0.027 0.159E+00 0.159E+00 + 0.127 0.204E+00 0.204E+00 + 0.227 0.592E-01 0.592E-01 + 0.327 0.527E-02 0.527E-02 + 0.427 0.388E-01 0.388E-01 + 0.527 0.830E-01 0.830E-01 + 0.627 0.951E-01 0.951E-01 + 0.727 0.116E+00 0.116E+00 + 0.827 0.133E+00 0.133E+00 + 0.927 0.145E+00 0.145E+00 + 1.027 0.700E-01 0.700E-01 + 1.127 0.258E-01 0.258E-01 + 1.227 0.108E-01 0.108E-01 + 1.327 0.109E-01 0.109E-01 + 1.427 0.562E-01 0.562E-01 + 1.527 0.449E-01 0.449E-01 + 1.627 0.487E-01 0.487E-01 + 1.727 0.105E+00 0.105E+00 + 1.827 0.390E-01 0.390E-01 + 1.927 0.108E-01 0.108E-01 + 2.027 0.141E-01 0.141E-01 + 2.127 0.492E-01 0.492E-01 + 2.227 0.930E-01 0.930E-01 + 2.327 0.537E-01 0.537E-01 + 2.427 0.528E-01 0.528E-01 + 2.527 0.672E-01 0.672E-01 + 2.627 0.597E-01 0.597E-01 + 2.727 0.559E-01 0.559E-01 + 2.827 0.344E-01 0.344E-01 + 2.927 0.461E-01 0.461E-01 + 3.027 0.449E-01 0.449E-01 + 3.127 0.342E-01 0.342E-01 + 3.227 0.176E-01 0.176E-01 + 3.327 0.458E-01 0.458E-01 + 3.427 0.709E-01 0.709E-01 + 3.527 0.447E-01 0.447E-01 + 3.627 0.371E-01 0.371E-01 + 3.727 0.551E-01 0.551E-01 + 3.827 0.264E-01 0.264E-01 + 3.927 0.510E-02 0.510E-02 + 4.027 0.127E-01 0.127E-01 + 4.127 0.364E-01 0.364E-01 + 4.227 0.287E-01 0.287E-01 + 4.327 0.142E-01 0.142E-01 + 4.427 0.209E-01 0.209E-01 + 4.527 0.432E-01 0.432E-01 + 4.627 0.265E-01 0.265E-01 + 4.727 0.437E-02 0.437E-02 + 4.827 0.691E-02 0.691E-02 + 4.927 0.474E-02 0.474E-02 + 5.027 0.707E-03 0.707E-03 + 5.127 0.454E-02 0.454E-02 + 5.227 0.141E-01 0.141E-01 + 5.327 0.830E-02 0.830E-02 + 5.427 0.101E-01 0.101E-01 + 5.527 0.783E-02 0.783E-02 + 5.627 0.884E-03 0.884E-03 + 5.727 0.138E-04 0.138E-04 + 5.827 0.301E-07 0.301E-07 + 5.927 0.180E-09 0.180E-09 + 6.027 0.787E-09 0.787E-09 + 6.127 0.137E-08 0.137E-08 + 6.227 0.920E-09 0.920E-09 + 6.327 0.111E-09 0.111E-09 + 6.427 0.188E-11 0.188E-11 + 6.527 0.432E-14 0.432E-14 diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#3(Si)_wfc#2(p) b/docs/src/assets/job/Job2/Si.pdos_atm#3(Si)_wfc#2(p) new file mode 100644 index 00000000..49678929 --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#3(Si)_wfc#2(p) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) pdos(E) pdos(E) + -3.973 0.503E-01 0.168E-01 0.168E-01 0.168E-01 + -3.873 0.861E-01 0.287E-01 0.287E-01 0.287E-01 + -3.773 0.132E+00 0.440E-01 0.440E-01 0.440E-01 + -3.673 0.106E+00 0.353E-01 0.353E-01 0.353E-01 + -3.573 0.122E+00 0.406E-01 0.406E-01 0.406E-01 + -3.473 0.155E+00 0.518E-01 0.518E-01 0.518E-01 + -3.373 0.856E-01 0.285E-01 0.285E-01 0.285E-01 + -3.273 0.761E-01 0.254E-01 0.254E-01 0.254E-01 + -3.173 0.105E+00 0.351E-01 0.351E-01 0.351E-01 + -3.073 0.134E+00 0.448E-01 0.448E-01 0.448E-01 + -2.973 0.411E-01 0.137E-01 0.137E-01 0.137E-01 + -2.873 0.712E-01 0.237E-01 0.237E-01 0.237E-01 + -2.773 0.158E+00 0.526E-01 0.526E-01 0.526E-01 + -2.673 0.171E+00 0.571E-01 0.571E-01 0.571E-01 + -2.573 0.209E+00 0.696E-01 0.696E-01 0.696E-01 + -2.473 0.774E-01 0.258E-01 0.258E-01 0.258E-01 + -2.373 0.315E-01 0.105E-01 0.105E-01 0.105E-01 + -2.273 0.478E-01 0.159E-01 0.159E-01 0.159E-01 + -2.173 0.158E-01 0.525E-02 0.525E-02 0.525E-02 + -2.073 0.364E-01 0.121E-01 0.121E-01 0.121E-01 + -1.973 0.466E-01 0.155E-01 0.155E-01 0.155E-01 + -1.873 0.262E-01 0.873E-02 0.873E-02 0.873E-02 + -1.773 0.413E-01 0.138E-01 0.138E-01 0.138E-01 + -1.673 0.972E-01 0.324E-01 0.324E-01 0.324E-01 + -1.573 0.146E+00 0.485E-01 0.485E-01 0.485E-01 + -1.473 0.101E+00 0.338E-01 0.338E-01 0.338E-01 + -1.373 0.416E-01 0.139E-01 0.139E-01 0.139E-01 + -1.273 0.104E-01 0.346E-02 0.346E-02 0.346E-02 + -1.173 0.447E-01 0.149E-01 0.149E-01 0.149E-01 + -1.073 0.634E-01 0.211E-01 0.211E-01 0.211E-01 + -0.973 0.182E-01 0.606E-02 0.606E-02 0.606E-02 + -0.873 0.633E-01 0.211E-01 0.211E-01 0.211E-01 + -0.773 0.259E+00 0.864E-01 0.864E-01 0.864E-01 + -0.673 0.416E+00 0.139E+00 0.139E+00 0.139E+00 + -0.573 0.453E+00 0.151E+00 0.151E+00 0.151E+00 + -0.473 0.455E+00 0.152E+00 0.152E+00 0.152E+00 + -0.373 0.363E+00 0.121E+00 0.121E+00 0.121E+00 + -0.273 0.104E+00 0.348E-01 0.348E-01 0.348E-01 + -0.173 0.361E-01 0.120E-01 0.120E-01 0.120E-01 + -0.073 0.123E+00 0.410E-01 0.410E-01 0.410E-01 + 0.027 0.259E+00 0.862E-01 0.862E-01 0.862E-01 + 0.127 0.324E+00 0.108E+00 0.108E+00 0.108E+00 + 0.227 0.924E-01 0.308E-01 0.308E-01 0.308E-01 + 0.327 0.682E-02 0.227E-02 0.227E-02 0.227E-02 + 0.427 0.401E-01 0.134E-01 0.134E-01 0.134E-01 + 0.527 0.873E-01 0.291E-01 0.291E-01 0.291E-01 + 0.627 0.110E+00 0.368E-01 0.368E-01 0.368E-01 + 0.727 0.154E+00 0.513E-01 0.513E-01 0.513E-01 + 0.827 0.227E+00 0.756E-01 0.756E-01 0.756E-01 + 0.927 0.207E+00 0.689E-01 0.689E-01 0.689E-01 + 1.027 0.748E-01 0.249E-01 0.249E-01 0.249E-01 + 1.127 0.286E-01 0.952E-02 0.952E-02 0.952E-02 + 1.227 0.125E-01 0.417E-02 0.417E-02 0.417E-02 + 1.327 0.148E-01 0.492E-02 0.492E-02 0.492E-02 + 1.427 0.772E-01 0.257E-01 0.257E-01 0.257E-01 + 1.527 0.669E-01 0.223E-01 0.223E-01 0.223E-01 + 1.627 0.126E+00 0.422E-01 0.422E-01 0.422E-01 + 1.727 0.279E+00 0.928E-01 0.928E-01 0.928E-01 + 1.827 0.299E+00 0.998E-01 0.998E-01 0.998E-01 + 1.927 0.336E+00 0.112E+00 0.112E+00 0.112E+00 + 2.027 0.248E+00 0.828E-01 0.828E-01 0.828E-01 + 2.127 0.497E+00 0.166E+00 0.166E+00 0.166E+00 + 2.227 0.614E+00 0.205E+00 0.205E+00 0.205E+00 + 2.327 0.452E+00 0.151E+00 0.151E+00 0.151E+00 + 2.427 0.529E+00 0.176E+00 0.176E+00 0.176E+00 + 2.527 0.674E+00 0.225E+00 0.225E+00 0.225E+00 + 2.627 0.310E+00 0.103E+00 0.103E+00 0.103E+00 + 2.727 0.162E+00 0.539E-01 0.539E-01 0.539E-01 + 2.827 0.238E+00 0.792E-01 0.792E-01 0.792E-01 + 2.927 0.695E+00 0.232E+00 0.232E+00 0.232E+00 + 3.027 0.845E+00 0.282E+00 0.282E+00 0.282E+00 + 3.127 0.519E+00 0.173E+00 0.173E+00 0.173E+00 + 3.227 0.437E+00 0.146E+00 0.146E+00 0.146E+00 + 3.327 0.692E+00 0.231E+00 0.231E+00 0.231E+00 + 3.427 0.731E+00 0.244E+00 0.244E+00 0.244E+00 + 3.527 0.693E+00 0.231E+00 0.231E+00 0.231E+00 + 3.627 0.578E+00 0.193E+00 0.193E+00 0.193E+00 + 3.727 0.745E+00 0.248E+00 0.248E+00 0.248E+00 + 3.827 0.580E+00 0.193E+00 0.193E+00 0.193E+00 + 3.927 0.452E+00 0.151E+00 0.151E+00 0.151E+00 + 4.027 0.684E+00 0.228E+00 0.228E+00 0.228E+00 + 4.127 0.821E+00 0.274E+00 0.274E+00 0.274E+00 + 4.227 0.596E+00 0.199E+00 0.199E+00 0.199E+00 + 4.327 0.435E+00 0.145E+00 0.145E+00 0.145E+00 + 4.427 0.655E+00 0.218E+00 0.218E+00 0.218E+00 + 4.527 0.741E+00 0.247E+00 0.247E+00 0.247E+00 + 4.627 0.320E+00 0.107E+00 0.107E+00 0.107E+00 + 4.727 0.309E+00 0.103E+00 0.103E+00 0.103E+00 + 4.827 0.781E+00 0.260E+00 0.260E+00 0.260E+00 + 4.927 0.720E+00 0.240E+00 0.240E+00 0.240E+00 + 5.027 0.345E+00 0.115E+00 0.115E+00 0.115E+00 + 5.127 0.242E+00 0.807E-01 0.807E-01 0.807E-01 + 5.227 0.267E+00 0.890E-01 0.890E-01 0.890E-01 + 5.327 0.171E+00 0.569E-01 0.569E-01 0.569E-01 + 5.427 0.298E+00 0.993E-01 0.993E-01 0.993E-01 + 5.527 0.295E+00 0.982E-01 0.982E-01 0.982E-01 + 5.627 0.169E+00 0.563E-01 0.563E-01 0.563E-01 + 5.727 0.181E+00 0.605E-01 0.605E-01 0.605E-01 + 5.827 0.589E-01 0.196E-01 0.196E-01 0.196E-01 + 5.927 0.167E-01 0.558E-02 0.558E-02 0.558E-02 + 6.027 0.678E-01 0.226E-01 0.226E-01 0.226E-01 + 6.127 0.570E-01 0.190E-01 0.190E-01 0.190E-01 + 6.227 0.175E-01 0.584E-02 0.584E-02 0.584E-02 + 6.327 0.178E-02 0.594E-03 0.594E-03 0.594E-03 + 6.427 0.296E-04 0.986E-05 0.986E-05 0.986E-05 + 6.527 0.678E-07 0.226E-07 0.226E-07 0.226E-07 diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#4(Si)_wfc#1(s) b/docs/src/assets/job/Job2/Si.pdos_atm#4(Si)_wfc#1(s) new file mode 100644 index 00000000..7c55f19a --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#4(Si)_wfc#1(s) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) + -3.973 0.134E+00 0.134E+00 + -3.873 0.212E+00 0.212E+00 + -3.773 0.311E+00 0.311E+00 + -3.673 0.260E+00 0.260E+00 + -3.573 0.309E+00 0.309E+00 + -3.473 0.372E+00 0.372E+00 + -3.373 0.215E+00 0.215E+00 + -3.273 0.213E+00 0.213E+00 + -3.173 0.268E+00 0.268E+00 + -3.073 0.318E+00 0.318E+00 + -2.973 0.936E-01 0.936E-01 + -2.873 0.145E+00 0.145E+00 + -2.773 0.317E+00 0.317E+00 + -2.673 0.340E+00 0.340E+00 + -2.573 0.424E+00 0.424E+00 + -2.473 0.164E+00 0.164E+00 + -2.373 0.662E-01 0.662E-01 + -2.273 0.994E-01 0.994E-01 + -2.173 0.323E-01 0.323E-01 + -2.073 0.722E-01 0.722E-01 + -1.973 0.919E-01 0.919E-01 + -1.873 0.468E-01 0.468E-01 + -1.773 0.645E-01 0.645E-01 + -1.673 0.128E+00 0.128E+00 + -1.573 0.195E+00 0.195E+00 + -1.473 0.139E+00 0.139E+00 + -1.373 0.546E-01 0.546E-01 + -1.273 0.130E-01 0.130E-01 + -1.173 0.545E-01 0.545E-01 + -1.073 0.771E-01 0.771E-01 + -0.973 0.178E-01 0.178E-01 + -0.873 0.461E-01 0.461E-01 + -0.773 0.200E+00 0.200E+00 + -0.673 0.325E+00 0.325E+00 + -0.573 0.357E+00 0.357E+00 + -0.473 0.361E+00 0.361E+00 + -0.373 0.315E+00 0.315E+00 + -0.273 0.104E+00 0.104E+00 + -0.173 0.344E-01 0.344E-01 + -0.073 0.970E-01 0.970E-01 + 0.027 0.159E+00 0.159E+00 + 0.127 0.204E+00 0.204E+00 + 0.227 0.592E-01 0.592E-01 + 0.327 0.527E-02 0.527E-02 + 0.427 0.388E-01 0.388E-01 + 0.527 0.830E-01 0.830E-01 + 0.627 0.951E-01 0.951E-01 + 0.727 0.116E+00 0.116E+00 + 0.827 0.133E+00 0.133E+00 + 0.927 0.145E+00 0.145E+00 + 1.027 0.700E-01 0.700E-01 + 1.127 0.258E-01 0.258E-01 + 1.227 0.108E-01 0.108E-01 + 1.327 0.109E-01 0.109E-01 + 1.427 0.562E-01 0.562E-01 + 1.527 0.449E-01 0.449E-01 + 1.627 0.487E-01 0.487E-01 + 1.727 0.105E+00 0.105E+00 + 1.827 0.390E-01 0.390E-01 + 1.927 0.108E-01 0.108E-01 + 2.027 0.141E-01 0.141E-01 + 2.127 0.492E-01 0.492E-01 + 2.227 0.930E-01 0.930E-01 + 2.327 0.538E-01 0.538E-01 + 2.427 0.529E-01 0.529E-01 + 2.527 0.672E-01 0.672E-01 + 2.627 0.597E-01 0.597E-01 + 2.727 0.559E-01 0.559E-01 + 2.827 0.344E-01 0.344E-01 + 2.927 0.461E-01 0.461E-01 + 3.027 0.450E-01 0.450E-01 + 3.127 0.342E-01 0.342E-01 + 3.227 0.177E-01 0.177E-01 + 3.327 0.458E-01 0.458E-01 + 3.427 0.709E-01 0.709E-01 + 3.527 0.447E-01 0.447E-01 + 3.627 0.371E-01 0.371E-01 + 3.727 0.551E-01 0.551E-01 + 3.827 0.264E-01 0.264E-01 + 3.927 0.510E-02 0.510E-02 + 4.027 0.127E-01 0.127E-01 + 4.127 0.364E-01 0.364E-01 + 4.227 0.287E-01 0.287E-01 + 4.327 0.142E-01 0.142E-01 + 4.427 0.209E-01 0.209E-01 + 4.527 0.432E-01 0.432E-01 + 4.627 0.265E-01 0.265E-01 + 4.727 0.437E-02 0.437E-02 + 4.827 0.691E-02 0.691E-02 + 4.927 0.474E-02 0.474E-02 + 5.027 0.706E-03 0.706E-03 + 5.127 0.455E-02 0.455E-02 + 5.227 0.141E-01 0.141E-01 + 5.327 0.830E-02 0.830E-02 + 5.427 0.101E-01 0.101E-01 + 5.527 0.783E-02 0.783E-02 + 5.627 0.884E-03 0.884E-03 + 5.727 0.138E-04 0.138E-04 + 5.827 0.303E-07 0.303E-07 + 5.927 0.504E-09 0.504E-09 + 6.027 0.221E-08 0.221E-08 + 6.127 0.168E-08 0.168E-08 + 6.227 0.392E-09 0.392E-09 + 6.327 0.355E-10 0.355E-10 + 6.427 0.580E-12 0.580E-12 + 6.527 0.133E-14 0.133E-14 diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#4(Si)_wfc#2(p) b/docs/src/assets/job/Job2/Si.pdos_atm#4(Si)_wfc#2(p) new file mode 100644 index 00000000..95fdff89 --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#4(Si)_wfc#2(p) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) pdos(E) pdos(E) + -3.973 0.489E-01 0.160E-01 0.160E-01 0.170E-01 + -3.873 0.852E-01 0.280E-01 0.280E-01 0.292E-01 + -3.773 0.131E+00 0.429E-01 0.429E-01 0.450E-01 + -3.673 0.104E+00 0.343E-01 0.343E-01 0.351E-01 + -3.573 0.118E+00 0.405E-01 0.405E-01 0.368E-01 + -3.473 0.151E+00 0.524E-01 0.524E-01 0.459E-01 + -3.373 0.835E-01 0.290E-01 0.290E-01 0.255E-01 + -3.273 0.767E-01 0.264E-01 0.264E-01 0.239E-01 + -3.173 0.110E+00 0.379E-01 0.379E-01 0.340E-01 + -3.073 0.141E+00 0.487E-01 0.487E-01 0.434E-01 + -2.973 0.426E-01 0.146E-01 0.146E-01 0.133E-01 + -2.873 0.699E-01 0.233E-01 0.233E-01 0.233E-01 + -2.773 0.154E+00 0.511E-01 0.511E-01 0.519E-01 + -2.673 0.170E+00 0.565E-01 0.565E-01 0.569E-01 + -2.573 0.210E+00 0.704E-01 0.704E-01 0.696E-01 + -2.473 0.791E-01 0.266E-01 0.266E-01 0.258E-01 + -2.373 0.338E-01 0.117E-01 0.117E-01 0.104E-01 + -2.273 0.517E-01 0.180E-01 0.180E-01 0.158E-01 + -2.173 0.167E-01 0.576E-02 0.576E-02 0.522E-02 + -2.073 0.365E-01 0.122E-01 0.122E-01 0.122E-01 + -1.973 0.467E-01 0.156E-01 0.156E-01 0.156E-01 + -1.873 0.258E-01 0.850E-02 0.850E-02 0.877E-02 + -1.773 0.373E-01 0.123E-01 0.123E-01 0.127E-01 + -1.673 0.729E-01 0.243E-01 0.243E-01 0.243E-01 + -1.573 0.105E+00 0.352E-01 0.352E-01 0.349E-01 + -1.473 0.787E-01 0.264E-01 0.264E-01 0.259E-01 + -1.373 0.384E-01 0.128E-01 0.128E-01 0.127E-01 + -1.273 0.103E-01 0.343E-02 0.343E-02 0.342E-02 + -1.173 0.446E-01 0.149E-01 0.149E-01 0.149E-01 + -1.073 0.633E-01 0.211E-01 0.211E-01 0.211E-01 + -0.973 0.183E-01 0.604E-02 0.604E-02 0.624E-02 + -0.873 0.638E-01 0.209E-01 0.209E-01 0.221E-01 + -0.773 0.259E+00 0.855E-01 0.855E-01 0.879E-01 + -0.673 0.413E+00 0.137E+00 0.137E+00 0.138E+00 + -0.573 0.452E+00 0.150E+00 0.150E+00 0.152E+00 + -0.473 0.459E+00 0.153E+00 0.153E+00 0.154E+00 + -0.373 0.358E+00 0.119E+00 0.119E+00 0.119E+00 + -0.273 0.950E-01 0.318E-01 0.318E-01 0.313E-01 + -0.173 0.330E-01 0.111E-01 0.111E-01 0.109E-01 + -0.073 0.118E+00 0.398E-01 0.398E-01 0.381E-01 + 0.027 0.253E+00 0.873E-01 0.873E-01 0.780E-01 + 0.127 0.322E+00 0.112E+00 0.112E+00 0.987E-01 + 0.227 0.926E-01 0.320E-01 0.320E-01 0.285E-01 + 0.327 0.682E-02 0.238E-02 0.238E-02 0.205E-02 + 0.427 0.399E-01 0.142E-01 0.142E-01 0.115E-01 + 0.527 0.870E-01 0.307E-01 0.307E-01 0.256E-01 + 0.627 0.112E+00 0.369E-01 0.369E-01 0.382E-01 + 0.727 0.155E+00 0.499E-01 0.499E-01 0.548E-01 + 0.827 0.222E+00 0.744E-01 0.744E-01 0.736E-01 + 0.927 0.204E+00 0.687E-01 0.687E-01 0.663E-01 + 1.027 0.722E-01 0.242E-01 0.242E-01 0.239E-01 + 1.127 0.189E-01 0.629E-02 0.629E-02 0.630E-02 + 1.227 0.719E-02 0.239E-02 0.239E-02 0.240E-02 + 1.327 0.150E-01 0.499E-02 0.499E-02 0.500E-02 + 1.427 0.805E-01 0.268E-01 0.268E-01 0.269E-01 + 1.527 0.695E-01 0.230E-01 0.230E-01 0.234E-01 + 1.627 0.128E+00 0.410E-01 0.410E-01 0.459E-01 + 1.727 0.280E+00 0.898E-01 0.898E-01 0.101E+00 + 1.827 0.303E+00 0.996E-01 0.996E-01 0.103E+00 + 1.927 0.347E+00 0.116E+00 0.116E+00 0.115E+00 + 2.027 0.260E+00 0.869E-01 0.869E-01 0.859E-01 + 2.127 0.504E+00 0.168E+00 0.168E+00 0.168E+00 + 2.227 0.617E+00 0.206E+00 0.206E+00 0.204E+00 + 2.327 0.458E+00 0.153E+00 0.153E+00 0.152E+00 + 2.427 0.547E+00 0.181E+00 0.181E+00 0.184E+00 + 2.527 0.701E+00 0.229E+00 0.229E+00 0.243E+00 + 2.627 0.306E+00 0.996E-01 0.996E-01 0.107E+00 + 2.727 0.147E+00 0.497E-01 0.497E-01 0.478E-01 + 2.827 0.236E+00 0.819E-01 0.819E-01 0.721E-01 + 2.927 0.693E+00 0.237E+00 0.237E+00 0.219E+00 + 3.027 0.837E+00 0.279E+00 0.279E+00 0.279E+00 + 3.127 0.518E+00 0.169E+00 0.169E+00 0.180E+00 + 3.227 0.437E+00 0.143E+00 0.143E+00 0.150E+00 + 3.327 0.699E+00 0.232E+00 0.232E+00 0.236E+00 + 3.427 0.740E+00 0.243E+00 0.243E+00 0.255E+00 + 3.527 0.691E+00 0.222E+00 0.222E+00 0.248E+00 + 3.627 0.555E+00 0.182E+00 0.182E+00 0.192E+00 + 3.727 0.721E+00 0.244E+00 0.244E+00 0.233E+00 + 3.827 0.588E+00 0.199E+00 0.199E+00 0.190E+00 + 3.927 0.448E+00 0.151E+00 0.151E+00 0.147E+00 + 4.027 0.664E+00 0.218E+00 0.218E+00 0.228E+00 + 4.127 0.820E+00 0.269E+00 0.269E+00 0.281E+00 + 4.227 0.614E+00 0.201E+00 0.201E+00 0.211E+00 + 4.327 0.437E+00 0.143E+00 0.143E+00 0.150E+00 + 4.427 0.634E+00 0.210E+00 0.210E+00 0.213E+00 + 4.527 0.726E+00 0.244E+00 0.244E+00 0.238E+00 + 4.627 0.320E+00 0.108E+00 0.108E+00 0.104E+00 + 4.727 0.307E+00 0.101E+00 0.101E+00 0.105E+00 + 4.827 0.810E+00 0.270E+00 0.270E+00 0.269E+00 + 4.927 0.755E+00 0.251E+00 0.251E+00 0.254E+00 + 5.027 0.353E+00 0.117E+00 0.117E+00 0.120E+00 + 5.127 0.237E+00 0.784E-01 0.784E-01 0.806E-01 + 5.227 0.263E+00 0.873E-01 0.873E-01 0.886E-01 + 5.327 0.170E+00 0.565E-01 0.565E-01 0.566E-01 + 5.427 0.293E+00 0.976E-01 0.976E-01 0.976E-01 + 5.527 0.285E+00 0.949E-01 0.949E-01 0.956E-01 + 5.627 0.160E+00 0.530E-01 0.530E-01 0.543E-01 + 5.727 0.179E+00 0.597E-01 0.597E-01 0.600E-01 + 5.827 0.589E-01 0.196E-01 0.196E-01 0.196E-01 + 5.927 0.167E-01 0.558E-02 0.558E-02 0.558E-02 + 6.027 0.675E-01 0.225E-01 0.225E-01 0.225E-01 + 6.127 0.555E-01 0.186E-01 0.186E-01 0.183E-01 + 6.227 0.161E-01 0.546E-02 0.546E-02 0.517E-02 + 6.327 0.160E-02 0.547E-03 0.547E-03 0.510E-03 + 6.427 0.265E-04 0.906E-05 0.906E-05 0.844E-05 + 6.527 0.608E-07 0.207E-07 0.207E-07 0.193E-07 diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#5(Si)_wfc#1(s) b/docs/src/assets/job/Job2/Si.pdos_atm#5(Si)_wfc#1(s) new file mode 100644 index 00000000..03f8b13b --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#5(Si)_wfc#1(s) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) + -3.973 0.134E+00 0.134E+00 + -3.873 0.212E+00 0.212E+00 + -3.773 0.311E+00 0.311E+00 + -3.673 0.260E+00 0.260E+00 + -3.573 0.309E+00 0.309E+00 + -3.473 0.373E+00 0.373E+00 + -3.373 0.215E+00 0.215E+00 + -3.273 0.213E+00 0.213E+00 + -3.173 0.268E+00 0.268E+00 + -3.073 0.318E+00 0.318E+00 + -2.973 0.940E-01 0.940E-01 + -2.873 0.145E+00 0.145E+00 + -2.773 0.318E+00 0.318E+00 + -2.673 0.341E+00 0.341E+00 + -2.573 0.424E+00 0.424E+00 + -2.473 0.164E+00 0.164E+00 + -2.373 0.662E-01 0.662E-01 + -2.273 0.995E-01 0.995E-01 + -2.173 0.324E-01 0.324E-01 + -2.073 0.723E-01 0.723E-01 + -1.973 0.921E-01 0.921E-01 + -1.873 0.469E-01 0.469E-01 + -1.773 0.650E-01 0.650E-01 + -1.673 0.128E+00 0.128E+00 + -1.573 0.195E+00 0.195E+00 + -1.473 0.138E+00 0.138E+00 + -1.373 0.542E-01 0.542E-01 + -1.273 0.130E-01 0.130E-01 + -1.173 0.544E-01 0.544E-01 + -1.073 0.770E-01 0.770E-01 + -0.973 0.178E-01 0.178E-01 + -0.873 0.461E-01 0.461E-01 + -0.773 0.200E+00 0.200E+00 + -0.673 0.324E+00 0.324E+00 + -0.573 0.357E+00 0.357E+00 + -0.473 0.361E+00 0.361E+00 + -0.373 0.315E+00 0.315E+00 + -0.273 0.105E+00 0.105E+00 + -0.173 0.344E-01 0.344E-01 + -0.073 0.970E-01 0.970E-01 + 0.027 0.159E+00 0.159E+00 + 0.127 0.204E+00 0.204E+00 + 0.227 0.592E-01 0.592E-01 + 0.327 0.527E-02 0.527E-02 + 0.427 0.388E-01 0.388E-01 + 0.527 0.830E-01 0.830E-01 + 0.627 0.951E-01 0.951E-01 + 0.727 0.116E+00 0.116E+00 + 0.827 0.133E+00 0.133E+00 + 0.927 0.145E+00 0.145E+00 + 1.027 0.700E-01 0.700E-01 + 1.127 0.258E-01 0.258E-01 + 1.227 0.108E-01 0.108E-01 + 1.327 0.109E-01 0.109E-01 + 1.427 0.562E-01 0.562E-01 + 1.527 0.449E-01 0.449E-01 + 1.627 0.487E-01 0.487E-01 + 1.727 0.105E+00 0.105E+00 + 1.827 0.390E-01 0.390E-01 + 1.927 0.108E-01 0.108E-01 + 2.027 0.141E-01 0.141E-01 + 2.127 0.492E-01 0.492E-01 + 2.227 0.930E-01 0.930E-01 + 2.327 0.537E-01 0.537E-01 + 2.427 0.528E-01 0.528E-01 + 2.527 0.672E-01 0.672E-01 + 2.627 0.597E-01 0.597E-01 + 2.727 0.559E-01 0.559E-01 + 2.827 0.344E-01 0.344E-01 + 2.927 0.461E-01 0.461E-01 + 3.027 0.449E-01 0.449E-01 + 3.127 0.342E-01 0.342E-01 + 3.227 0.176E-01 0.176E-01 + 3.327 0.458E-01 0.458E-01 + 3.427 0.709E-01 0.709E-01 + 3.527 0.447E-01 0.447E-01 + 3.627 0.371E-01 0.371E-01 + 3.727 0.551E-01 0.551E-01 + 3.827 0.264E-01 0.264E-01 + 3.927 0.510E-02 0.510E-02 + 4.027 0.127E-01 0.127E-01 + 4.127 0.364E-01 0.364E-01 + 4.227 0.287E-01 0.287E-01 + 4.327 0.142E-01 0.142E-01 + 4.427 0.209E-01 0.209E-01 + 4.527 0.432E-01 0.432E-01 + 4.627 0.265E-01 0.265E-01 + 4.727 0.437E-02 0.437E-02 + 4.827 0.691E-02 0.691E-02 + 4.927 0.474E-02 0.474E-02 + 5.027 0.707E-03 0.707E-03 + 5.127 0.454E-02 0.454E-02 + 5.227 0.141E-01 0.141E-01 + 5.327 0.830E-02 0.830E-02 + 5.427 0.101E-01 0.101E-01 + 5.527 0.783E-02 0.783E-02 + 5.627 0.884E-03 0.884E-03 + 5.727 0.138E-04 0.138E-04 + 5.827 0.301E-07 0.301E-07 + 5.927 0.180E-09 0.180E-09 + 6.027 0.787E-09 0.787E-09 + 6.127 0.137E-08 0.137E-08 + 6.227 0.920E-09 0.920E-09 + 6.327 0.111E-09 0.111E-09 + 6.427 0.188E-11 0.188E-11 + 6.527 0.432E-14 0.432E-14 diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#5(Si)_wfc#2(p) b/docs/src/assets/job/Job2/Si.pdos_atm#5(Si)_wfc#2(p) new file mode 100644 index 00000000..49678929 --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#5(Si)_wfc#2(p) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) pdos(E) pdos(E) + -3.973 0.503E-01 0.168E-01 0.168E-01 0.168E-01 + -3.873 0.861E-01 0.287E-01 0.287E-01 0.287E-01 + -3.773 0.132E+00 0.440E-01 0.440E-01 0.440E-01 + -3.673 0.106E+00 0.353E-01 0.353E-01 0.353E-01 + -3.573 0.122E+00 0.406E-01 0.406E-01 0.406E-01 + -3.473 0.155E+00 0.518E-01 0.518E-01 0.518E-01 + -3.373 0.856E-01 0.285E-01 0.285E-01 0.285E-01 + -3.273 0.761E-01 0.254E-01 0.254E-01 0.254E-01 + -3.173 0.105E+00 0.351E-01 0.351E-01 0.351E-01 + -3.073 0.134E+00 0.448E-01 0.448E-01 0.448E-01 + -2.973 0.411E-01 0.137E-01 0.137E-01 0.137E-01 + -2.873 0.712E-01 0.237E-01 0.237E-01 0.237E-01 + -2.773 0.158E+00 0.526E-01 0.526E-01 0.526E-01 + -2.673 0.171E+00 0.571E-01 0.571E-01 0.571E-01 + -2.573 0.209E+00 0.696E-01 0.696E-01 0.696E-01 + -2.473 0.774E-01 0.258E-01 0.258E-01 0.258E-01 + -2.373 0.315E-01 0.105E-01 0.105E-01 0.105E-01 + -2.273 0.478E-01 0.159E-01 0.159E-01 0.159E-01 + -2.173 0.158E-01 0.525E-02 0.525E-02 0.525E-02 + -2.073 0.364E-01 0.121E-01 0.121E-01 0.121E-01 + -1.973 0.466E-01 0.155E-01 0.155E-01 0.155E-01 + -1.873 0.262E-01 0.873E-02 0.873E-02 0.873E-02 + -1.773 0.413E-01 0.138E-01 0.138E-01 0.138E-01 + -1.673 0.972E-01 0.324E-01 0.324E-01 0.324E-01 + -1.573 0.146E+00 0.485E-01 0.485E-01 0.485E-01 + -1.473 0.101E+00 0.338E-01 0.338E-01 0.338E-01 + -1.373 0.416E-01 0.139E-01 0.139E-01 0.139E-01 + -1.273 0.104E-01 0.346E-02 0.346E-02 0.346E-02 + -1.173 0.447E-01 0.149E-01 0.149E-01 0.149E-01 + -1.073 0.634E-01 0.211E-01 0.211E-01 0.211E-01 + -0.973 0.182E-01 0.606E-02 0.606E-02 0.606E-02 + -0.873 0.633E-01 0.211E-01 0.211E-01 0.211E-01 + -0.773 0.259E+00 0.864E-01 0.864E-01 0.864E-01 + -0.673 0.416E+00 0.139E+00 0.139E+00 0.139E+00 + -0.573 0.453E+00 0.151E+00 0.151E+00 0.151E+00 + -0.473 0.455E+00 0.152E+00 0.152E+00 0.152E+00 + -0.373 0.363E+00 0.121E+00 0.121E+00 0.121E+00 + -0.273 0.104E+00 0.348E-01 0.348E-01 0.348E-01 + -0.173 0.361E-01 0.120E-01 0.120E-01 0.120E-01 + -0.073 0.123E+00 0.410E-01 0.410E-01 0.410E-01 + 0.027 0.259E+00 0.862E-01 0.862E-01 0.862E-01 + 0.127 0.324E+00 0.108E+00 0.108E+00 0.108E+00 + 0.227 0.924E-01 0.308E-01 0.308E-01 0.308E-01 + 0.327 0.682E-02 0.227E-02 0.227E-02 0.227E-02 + 0.427 0.401E-01 0.134E-01 0.134E-01 0.134E-01 + 0.527 0.873E-01 0.291E-01 0.291E-01 0.291E-01 + 0.627 0.110E+00 0.368E-01 0.368E-01 0.368E-01 + 0.727 0.154E+00 0.513E-01 0.513E-01 0.513E-01 + 0.827 0.227E+00 0.756E-01 0.756E-01 0.756E-01 + 0.927 0.207E+00 0.689E-01 0.689E-01 0.689E-01 + 1.027 0.748E-01 0.249E-01 0.249E-01 0.249E-01 + 1.127 0.286E-01 0.952E-02 0.952E-02 0.952E-02 + 1.227 0.125E-01 0.417E-02 0.417E-02 0.417E-02 + 1.327 0.148E-01 0.492E-02 0.492E-02 0.492E-02 + 1.427 0.772E-01 0.257E-01 0.257E-01 0.257E-01 + 1.527 0.669E-01 0.223E-01 0.223E-01 0.223E-01 + 1.627 0.126E+00 0.422E-01 0.422E-01 0.422E-01 + 1.727 0.279E+00 0.928E-01 0.928E-01 0.928E-01 + 1.827 0.299E+00 0.998E-01 0.998E-01 0.998E-01 + 1.927 0.336E+00 0.112E+00 0.112E+00 0.112E+00 + 2.027 0.248E+00 0.828E-01 0.828E-01 0.828E-01 + 2.127 0.497E+00 0.166E+00 0.166E+00 0.166E+00 + 2.227 0.614E+00 0.205E+00 0.205E+00 0.205E+00 + 2.327 0.452E+00 0.151E+00 0.151E+00 0.151E+00 + 2.427 0.529E+00 0.176E+00 0.176E+00 0.176E+00 + 2.527 0.674E+00 0.225E+00 0.225E+00 0.225E+00 + 2.627 0.310E+00 0.103E+00 0.103E+00 0.103E+00 + 2.727 0.162E+00 0.539E-01 0.539E-01 0.539E-01 + 2.827 0.238E+00 0.792E-01 0.792E-01 0.792E-01 + 2.927 0.695E+00 0.232E+00 0.232E+00 0.232E+00 + 3.027 0.845E+00 0.282E+00 0.282E+00 0.282E+00 + 3.127 0.519E+00 0.173E+00 0.173E+00 0.173E+00 + 3.227 0.437E+00 0.146E+00 0.146E+00 0.146E+00 + 3.327 0.692E+00 0.231E+00 0.231E+00 0.231E+00 + 3.427 0.731E+00 0.244E+00 0.244E+00 0.244E+00 + 3.527 0.693E+00 0.231E+00 0.231E+00 0.231E+00 + 3.627 0.578E+00 0.193E+00 0.193E+00 0.193E+00 + 3.727 0.745E+00 0.248E+00 0.248E+00 0.248E+00 + 3.827 0.580E+00 0.193E+00 0.193E+00 0.193E+00 + 3.927 0.452E+00 0.151E+00 0.151E+00 0.151E+00 + 4.027 0.684E+00 0.228E+00 0.228E+00 0.228E+00 + 4.127 0.821E+00 0.274E+00 0.274E+00 0.274E+00 + 4.227 0.596E+00 0.199E+00 0.199E+00 0.199E+00 + 4.327 0.435E+00 0.145E+00 0.145E+00 0.145E+00 + 4.427 0.655E+00 0.218E+00 0.218E+00 0.218E+00 + 4.527 0.741E+00 0.247E+00 0.247E+00 0.247E+00 + 4.627 0.320E+00 0.107E+00 0.107E+00 0.107E+00 + 4.727 0.309E+00 0.103E+00 0.103E+00 0.103E+00 + 4.827 0.781E+00 0.260E+00 0.260E+00 0.260E+00 + 4.927 0.720E+00 0.240E+00 0.240E+00 0.240E+00 + 5.027 0.345E+00 0.115E+00 0.115E+00 0.115E+00 + 5.127 0.242E+00 0.807E-01 0.807E-01 0.807E-01 + 5.227 0.267E+00 0.890E-01 0.890E-01 0.890E-01 + 5.327 0.171E+00 0.569E-01 0.569E-01 0.569E-01 + 5.427 0.298E+00 0.993E-01 0.993E-01 0.993E-01 + 5.527 0.295E+00 0.982E-01 0.982E-01 0.982E-01 + 5.627 0.169E+00 0.563E-01 0.563E-01 0.563E-01 + 5.727 0.181E+00 0.605E-01 0.605E-01 0.605E-01 + 5.827 0.589E-01 0.196E-01 0.196E-01 0.196E-01 + 5.927 0.167E-01 0.558E-02 0.558E-02 0.558E-02 + 6.027 0.678E-01 0.226E-01 0.226E-01 0.226E-01 + 6.127 0.570E-01 0.190E-01 0.190E-01 0.190E-01 + 6.227 0.175E-01 0.584E-02 0.584E-02 0.584E-02 + 6.327 0.178E-02 0.594E-03 0.594E-03 0.594E-03 + 6.427 0.296E-04 0.986E-05 0.986E-05 0.986E-05 + 6.527 0.678E-07 0.226E-07 0.226E-07 0.226E-07 diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#6(Si)_wfc#1(s) b/docs/src/assets/job/Job2/Si.pdos_atm#6(Si)_wfc#1(s) new file mode 100644 index 00000000..03f8b13b --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#6(Si)_wfc#1(s) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) + -3.973 0.134E+00 0.134E+00 + -3.873 0.212E+00 0.212E+00 + -3.773 0.311E+00 0.311E+00 + -3.673 0.260E+00 0.260E+00 + -3.573 0.309E+00 0.309E+00 + -3.473 0.373E+00 0.373E+00 + -3.373 0.215E+00 0.215E+00 + -3.273 0.213E+00 0.213E+00 + -3.173 0.268E+00 0.268E+00 + -3.073 0.318E+00 0.318E+00 + -2.973 0.940E-01 0.940E-01 + -2.873 0.145E+00 0.145E+00 + -2.773 0.318E+00 0.318E+00 + -2.673 0.341E+00 0.341E+00 + -2.573 0.424E+00 0.424E+00 + -2.473 0.164E+00 0.164E+00 + -2.373 0.662E-01 0.662E-01 + -2.273 0.995E-01 0.995E-01 + -2.173 0.324E-01 0.324E-01 + -2.073 0.723E-01 0.723E-01 + -1.973 0.921E-01 0.921E-01 + -1.873 0.469E-01 0.469E-01 + -1.773 0.650E-01 0.650E-01 + -1.673 0.128E+00 0.128E+00 + -1.573 0.195E+00 0.195E+00 + -1.473 0.138E+00 0.138E+00 + -1.373 0.542E-01 0.542E-01 + -1.273 0.130E-01 0.130E-01 + -1.173 0.544E-01 0.544E-01 + -1.073 0.770E-01 0.770E-01 + -0.973 0.178E-01 0.178E-01 + -0.873 0.461E-01 0.461E-01 + -0.773 0.200E+00 0.200E+00 + -0.673 0.324E+00 0.324E+00 + -0.573 0.357E+00 0.357E+00 + -0.473 0.361E+00 0.361E+00 + -0.373 0.315E+00 0.315E+00 + -0.273 0.105E+00 0.105E+00 + -0.173 0.344E-01 0.344E-01 + -0.073 0.970E-01 0.970E-01 + 0.027 0.159E+00 0.159E+00 + 0.127 0.204E+00 0.204E+00 + 0.227 0.592E-01 0.592E-01 + 0.327 0.527E-02 0.527E-02 + 0.427 0.388E-01 0.388E-01 + 0.527 0.830E-01 0.830E-01 + 0.627 0.951E-01 0.951E-01 + 0.727 0.116E+00 0.116E+00 + 0.827 0.133E+00 0.133E+00 + 0.927 0.145E+00 0.145E+00 + 1.027 0.700E-01 0.700E-01 + 1.127 0.258E-01 0.258E-01 + 1.227 0.108E-01 0.108E-01 + 1.327 0.109E-01 0.109E-01 + 1.427 0.562E-01 0.562E-01 + 1.527 0.449E-01 0.449E-01 + 1.627 0.487E-01 0.487E-01 + 1.727 0.105E+00 0.105E+00 + 1.827 0.390E-01 0.390E-01 + 1.927 0.108E-01 0.108E-01 + 2.027 0.141E-01 0.141E-01 + 2.127 0.492E-01 0.492E-01 + 2.227 0.930E-01 0.930E-01 + 2.327 0.537E-01 0.537E-01 + 2.427 0.528E-01 0.528E-01 + 2.527 0.672E-01 0.672E-01 + 2.627 0.597E-01 0.597E-01 + 2.727 0.559E-01 0.559E-01 + 2.827 0.344E-01 0.344E-01 + 2.927 0.461E-01 0.461E-01 + 3.027 0.449E-01 0.449E-01 + 3.127 0.342E-01 0.342E-01 + 3.227 0.176E-01 0.176E-01 + 3.327 0.458E-01 0.458E-01 + 3.427 0.709E-01 0.709E-01 + 3.527 0.447E-01 0.447E-01 + 3.627 0.371E-01 0.371E-01 + 3.727 0.551E-01 0.551E-01 + 3.827 0.264E-01 0.264E-01 + 3.927 0.510E-02 0.510E-02 + 4.027 0.127E-01 0.127E-01 + 4.127 0.364E-01 0.364E-01 + 4.227 0.287E-01 0.287E-01 + 4.327 0.142E-01 0.142E-01 + 4.427 0.209E-01 0.209E-01 + 4.527 0.432E-01 0.432E-01 + 4.627 0.265E-01 0.265E-01 + 4.727 0.437E-02 0.437E-02 + 4.827 0.691E-02 0.691E-02 + 4.927 0.474E-02 0.474E-02 + 5.027 0.707E-03 0.707E-03 + 5.127 0.454E-02 0.454E-02 + 5.227 0.141E-01 0.141E-01 + 5.327 0.830E-02 0.830E-02 + 5.427 0.101E-01 0.101E-01 + 5.527 0.783E-02 0.783E-02 + 5.627 0.884E-03 0.884E-03 + 5.727 0.138E-04 0.138E-04 + 5.827 0.301E-07 0.301E-07 + 5.927 0.180E-09 0.180E-09 + 6.027 0.787E-09 0.787E-09 + 6.127 0.137E-08 0.137E-08 + 6.227 0.920E-09 0.920E-09 + 6.327 0.111E-09 0.111E-09 + 6.427 0.188E-11 0.188E-11 + 6.527 0.432E-14 0.432E-14 diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#6(Si)_wfc#2(p) b/docs/src/assets/job/Job2/Si.pdos_atm#6(Si)_wfc#2(p) new file mode 100644 index 00000000..49678929 --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#6(Si)_wfc#2(p) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) pdos(E) pdos(E) + -3.973 0.503E-01 0.168E-01 0.168E-01 0.168E-01 + -3.873 0.861E-01 0.287E-01 0.287E-01 0.287E-01 + -3.773 0.132E+00 0.440E-01 0.440E-01 0.440E-01 + -3.673 0.106E+00 0.353E-01 0.353E-01 0.353E-01 + -3.573 0.122E+00 0.406E-01 0.406E-01 0.406E-01 + -3.473 0.155E+00 0.518E-01 0.518E-01 0.518E-01 + -3.373 0.856E-01 0.285E-01 0.285E-01 0.285E-01 + -3.273 0.761E-01 0.254E-01 0.254E-01 0.254E-01 + -3.173 0.105E+00 0.351E-01 0.351E-01 0.351E-01 + -3.073 0.134E+00 0.448E-01 0.448E-01 0.448E-01 + -2.973 0.411E-01 0.137E-01 0.137E-01 0.137E-01 + -2.873 0.712E-01 0.237E-01 0.237E-01 0.237E-01 + -2.773 0.158E+00 0.526E-01 0.526E-01 0.526E-01 + -2.673 0.171E+00 0.571E-01 0.571E-01 0.571E-01 + -2.573 0.209E+00 0.696E-01 0.696E-01 0.696E-01 + -2.473 0.774E-01 0.258E-01 0.258E-01 0.258E-01 + -2.373 0.315E-01 0.105E-01 0.105E-01 0.105E-01 + -2.273 0.478E-01 0.159E-01 0.159E-01 0.159E-01 + -2.173 0.158E-01 0.525E-02 0.525E-02 0.525E-02 + -2.073 0.364E-01 0.121E-01 0.121E-01 0.121E-01 + -1.973 0.466E-01 0.155E-01 0.155E-01 0.155E-01 + -1.873 0.262E-01 0.873E-02 0.873E-02 0.873E-02 + -1.773 0.413E-01 0.138E-01 0.138E-01 0.138E-01 + -1.673 0.972E-01 0.324E-01 0.324E-01 0.324E-01 + -1.573 0.146E+00 0.485E-01 0.485E-01 0.485E-01 + -1.473 0.101E+00 0.338E-01 0.338E-01 0.338E-01 + -1.373 0.416E-01 0.139E-01 0.139E-01 0.139E-01 + -1.273 0.104E-01 0.346E-02 0.346E-02 0.346E-02 + -1.173 0.447E-01 0.149E-01 0.149E-01 0.149E-01 + -1.073 0.634E-01 0.211E-01 0.211E-01 0.211E-01 + -0.973 0.182E-01 0.606E-02 0.606E-02 0.606E-02 + -0.873 0.633E-01 0.211E-01 0.211E-01 0.211E-01 + -0.773 0.259E+00 0.864E-01 0.864E-01 0.864E-01 + -0.673 0.416E+00 0.139E+00 0.139E+00 0.139E+00 + -0.573 0.453E+00 0.151E+00 0.151E+00 0.151E+00 + -0.473 0.455E+00 0.152E+00 0.152E+00 0.152E+00 + -0.373 0.363E+00 0.121E+00 0.121E+00 0.121E+00 + -0.273 0.104E+00 0.348E-01 0.348E-01 0.348E-01 + -0.173 0.361E-01 0.120E-01 0.120E-01 0.120E-01 + -0.073 0.123E+00 0.410E-01 0.410E-01 0.410E-01 + 0.027 0.259E+00 0.862E-01 0.862E-01 0.862E-01 + 0.127 0.324E+00 0.108E+00 0.108E+00 0.108E+00 + 0.227 0.924E-01 0.308E-01 0.308E-01 0.308E-01 + 0.327 0.682E-02 0.227E-02 0.227E-02 0.227E-02 + 0.427 0.401E-01 0.134E-01 0.134E-01 0.134E-01 + 0.527 0.873E-01 0.291E-01 0.291E-01 0.291E-01 + 0.627 0.110E+00 0.368E-01 0.368E-01 0.368E-01 + 0.727 0.154E+00 0.513E-01 0.513E-01 0.513E-01 + 0.827 0.227E+00 0.756E-01 0.756E-01 0.756E-01 + 0.927 0.207E+00 0.689E-01 0.689E-01 0.689E-01 + 1.027 0.748E-01 0.249E-01 0.249E-01 0.249E-01 + 1.127 0.286E-01 0.952E-02 0.952E-02 0.952E-02 + 1.227 0.125E-01 0.417E-02 0.417E-02 0.417E-02 + 1.327 0.148E-01 0.492E-02 0.492E-02 0.492E-02 + 1.427 0.772E-01 0.257E-01 0.257E-01 0.257E-01 + 1.527 0.669E-01 0.223E-01 0.223E-01 0.223E-01 + 1.627 0.126E+00 0.422E-01 0.422E-01 0.422E-01 + 1.727 0.279E+00 0.928E-01 0.928E-01 0.928E-01 + 1.827 0.299E+00 0.998E-01 0.998E-01 0.998E-01 + 1.927 0.336E+00 0.112E+00 0.112E+00 0.112E+00 + 2.027 0.248E+00 0.828E-01 0.828E-01 0.828E-01 + 2.127 0.497E+00 0.166E+00 0.166E+00 0.166E+00 + 2.227 0.614E+00 0.205E+00 0.205E+00 0.205E+00 + 2.327 0.452E+00 0.151E+00 0.151E+00 0.151E+00 + 2.427 0.529E+00 0.176E+00 0.176E+00 0.176E+00 + 2.527 0.674E+00 0.225E+00 0.225E+00 0.225E+00 + 2.627 0.310E+00 0.103E+00 0.103E+00 0.103E+00 + 2.727 0.162E+00 0.539E-01 0.539E-01 0.539E-01 + 2.827 0.238E+00 0.792E-01 0.792E-01 0.792E-01 + 2.927 0.695E+00 0.232E+00 0.232E+00 0.232E+00 + 3.027 0.845E+00 0.282E+00 0.282E+00 0.282E+00 + 3.127 0.519E+00 0.173E+00 0.173E+00 0.173E+00 + 3.227 0.437E+00 0.146E+00 0.146E+00 0.146E+00 + 3.327 0.692E+00 0.231E+00 0.231E+00 0.231E+00 + 3.427 0.731E+00 0.244E+00 0.244E+00 0.244E+00 + 3.527 0.693E+00 0.231E+00 0.231E+00 0.231E+00 + 3.627 0.578E+00 0.193E+00 0.193E+00 0.193E+00 + 3.727 0.745E+00 0.248E+00 0.248E+00 0.248E+00 + 3.827 0.580E+00 0.193E+00 0.193E+00 0.193E+00 + 3.927 0.452E+00 0.151E+00 0.151E+00 0.151E+00 + 4.027 0.684E+00 0.228E+00 0.228E+00 0.228E+00 + 4.127 0.821E+00 0.274E+00 0.274E+00 0.274E+00 + 4.227 0.596E+00 0.199E+00 0.199E+00 0.199E+00 + 4.327 0.435E+00 0.145E+00 0.145E+00 0.145E+00 + 4.427 0.655E+00 0.218E+00 0.218E+00 0.218E+00 + 4.527 0.741E+00 0.247E+00 0.247E+00 0.247E+00 + 4.627 0.320E+00 0.107E+00 0.107E+00 0.107E+00 + 4.727 0.309E+00 0.103E+00 0.103E+00 0.103E+00 + 4.827 0.781E+00 0.260E+00 0.260E+00 0.260E+00 + 4.927 0.720E+00 0.240E+00 0.240E+00 0.240E+00 + 5.027 0.345E+00 0.115E+00 0.115E+00 0.115E+00 + 5.127 0.242E+00 0.807E-01 0.807E-01 0.807E-01 + 5.227 0.267E+00 0.890E-01 0.890E-01 0.890E-01 + 5.327 0.171E+00 0.569E-01 0.569E-01 0.569E-01 + 5.427 0.298E+00 0.993E-01 0.993E-01 0.993E-01 + 5.527 0.295E+00 0.982E-01 0.982E-01 0.982E-01 + 5.627 0.169E+00 0.563E-01 0.563E-01 0.563E-01 + 5.727 0.181E+00 0.605E-01 0.605E-01 0.605E-01 + 5.827 0.589E-01 0.196E-01 0.196E-01 0.196E-01 + 5.927 0.167E-01 0.558E-02 0.558E-02 0.558E-02 + 6.027 0.678E-01 0.226E-01 0.226E-01 0.226E-01 + 6.127 0.570E-01 0.190E-01 0.190E-01 0.190E-01 + 6.227 0.175E-01 0.584E-02 0.584E-02 0.584E-02 + 6.327 0.178E-02 0.594E-03 0.594E-03 0.594E-03 + 6.427 0.296E-04 0.986E-05 0.986E-05 0.986E-05 + 6.527 0.678E-07 0.226E-07 0.226E-07 0.226E-07 diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#7(Si)_wfc#1(s) b/docs/src/assets/job/Job2/Si.pdos_atm#7(Si)_wfc#1(s) new file mode 100644 index 00000000..03f8b13b --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#7(Si)_wfc#1(s) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) + -3.973 0.134E+00 0.134E+00 + -3.873 0.212E+00 0.212E+00 + -3.773 0.311E+00 0.311E+00 + -3.673 0.260E+00 0.260E+00 + -3.573 0.309E+00 0.309E+00 + -3.473 0.373E+00 0.373E+00 + -3.373 0.215E+00 0.215E+00 + -3.273 0.213E+00 0.213E+00 + -3.173 0.268E+00 0.268E+00 + -3.073 0.318E+00 0.318E+00 + -2.973 0.940E-01 0.940E-01 + -2.873 0.145E+00 0.145E+00 + -2.773 0.318E+00 0.318E+00 + -2.673 0.341E+00 0.341E+00 + -2.573 0.424E+00 0.424E+00 + -2.473 0.164E+00 0.164E+00 + -2.373 0.662E-01 0.662E-01 + -2.273 0.995E-01 0.995E-01 + -2.173 0.324E-01 0.324E-01 + -2.073 0.723E-01 0.723E-01 + -1.973 0.921E-01 0.921E-01 + -1.873 0.469E-01 0.469E-01 + -1.773 0.650E-01 0.650E-01 + -1.673 0.128E+00 0.128E+00 + -1.573 0.195E+00 0.195E+00 + -1.473 0.138E+00 0.138E+00 + -1.373 0.542E-01 0.542E-01 + -1.273 0.130E-01 0.130E-01 + -1.173 0.544E-01 0.544E-01 + -1.073 0.770E-01 0.770E-01 + -0.973 0.178E-01 0.178E-01 + -0.873 0.461E-01 0.461E-01 + -0.773 0.200E+00 0.200E+00 + -0.673 0.324E+00 0.324E+00 + -0.573 0.357E+00 0.357E+00 + -0.473 0.361E+00 0.361E+00 + -0.373 0.315E+00 0.315E+00 + -0.273 0.105E+00 0.105E+00 + -0.173 0.344E-01 0.344E-01 + -0.073 0.970E-01 0.970E-01 + 0.027 0.159E+00 0.159E+00 + 0.127 0.204E+00 0.204E+00 + 0.227 0.592E-01 0.592E-01 + 0.327 0.527E-02 0.527E-02 + 0.427 0.388E-01 0.388E-01 + 0.527 0.830E-01 0.830E-01 + 0.627 0.951E-01 0.951E-01 + 0.727 0.116E+00 0.116E+00 + 0.827 0.133E+00 0.133E+00 + 0.927 0.145E+00 0.145E+00 + 1.027 0.700E-01 0.700E-01 + 1.127 0.258E-01 0.258E-01 + 1.227 0.108E-01 0.108E-01 + 1.327 0.109E-01 0.109E-01 + 1.427 0.562E-01 0.562E-01 + 1.527 0.449E-01 0.449E-01 + 1.627 0.487E-01 0.487E-01 + 1.727 0.105E+00 0.105E+00 + 1.827 0.390E-01 0.390E-01 + 1.927 0.108E-01 0.108E-01 + 2.027 0.141E-01 0.141E-01 + 2.127 0.492E-01 0.492E-01 + 2.227 0.930E-01 0.930E-01 + 2.327 0.537E-01 0.537E-01 + 2.427 0.528E-01 0.528E-01 + 2.527 0.672E-01 0.672E-01 + 2.627 0.597E-01 0.597E-01 + 2.727 0.559E-01 0.559E-01 + 2.827 0.344E-01 0.344E-01 + 2.927 0.461E-01 0.461E-01 + 3.027 0.449E-01 0.449E-01 + 3.127 0.342E-01 0.342E-01 + 3.227 0.176E-01 0.176E-01 + 3.327 0.458E-01 0.458E-01 + 3.427 0.709E-01 0.709E-01 + 3.527 0.447E-01 0.447E-01 + 3.627 0.371E-01 0.371E-01 + 3.727 0.551E-01 0.551E-01 + 3.827 0.264E-01 0.264E-01 + 3.927 0.510E-02 0.510E-02 + 4.027 0.127E-01 0.127E-01 + 4.127 0.364E-01 0.364E-01 + 4.227 0.287E-01 0.287E-01 + 4.327 0.142E-01 0.142E-01 + 4.427 0.209E-01 0.209E-01 + 4.527 0.432E-01 0.432E-01 + 4.627 0.265E-01 0.265E-01 + 4.727 0.437E-02 0.437E-02 + 4.827 0.691E-02 0.691E-02 + 4.927 0.474E-02 0.474E-02 + 5.027 0.707E-03 0.707E-03 + 5.127 0.454E-02 0.454E-02 + 5.227 0.141E-01 0.141E-01 + 5.327 0.830E-02 0.830E-02 + 5.427 0.101E-01 0.101E-01 + 5.527 0.783E-02 0.783E-02 + 5.627 0.884E-03 0.884E-03 + 5.727 0.138E-04 0.138E-04 + 5.827 0.301E-07 0.301E-07 + 5.927 0.180E-09 0.180E-09 + 6.027 0.787E-09 0.787E-09 + 6.127 0.137E-08 0.137E-08 + 6.227 0.920E-09 0.920E-09 + 6.327 0.111E-09 0.111E-09 + 6.427 0.188E-11 0.188E-11 + 6.527 0.432E-14 0.432E-14 diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#7(Si)_wfc#2(p) b/docs/src/assets/job/Job2/Si.pdos_atm#7(Si)_wfc#2(p) new file mode 100644 index 00000000..49678929 --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#7(Si)_wfc#2(p) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) pdos(E) pdos(E) + -3.973 0.503E-01 0.168E-01 0.168E-01 0.168E-01 + -3.873 0.861E-01 0.287E-01 0.287E-01 0.287E-01 + -3.773 0.132E+00 0.440E-01 0.440E-01 0.440E-01 + -3.673 0.106E+00 0.353E-01 0.353E-01 0.353E-01 + -3.573 0.122E+00 0.406E-01 0.406E-01 0.406E-01 + -3.473 0.155E+00 0.518E-01 0.518E-01 0.518E-01 + -3.373 0.856E-01 0.285E-01 0.285E-01 0.285E-01 + -3.273 0.761E-01 0.254E-01 0.254E-01 0.254E-01 + -3.173 0.105E+00 0.351E-01 0.351E-01 0.351E-01 + -3.073 0.134E+00 0.448E-01 0.448E-01 0.448E-01 + -2.973 0.411E-01 0.137E-01 0.137E-01 0.137E-01 + -2.873 0.712E-01 0.237E-01 0.237E-01 0.237E-01 + -2.773 0.158E+00 0.526E-01 0.526E-01 0.526E-01 + -2.673 0.171E+00 0.571E-01 0.571E-01 0.571E-01 + -2.573 0.209E+00 0.696E-01 0.696E-01 0.696E-01 + -2.473 0.774E-01 0.258E-01 0.258E-01 0.258E-01 + -2.373 0.315E-01 0.105E-01 0.105E-01 0.105E-01 + -2.273 0.478E-01 0.159E-01 0.159E-01 0.159E-01 + -2.173 0.158E-01 0.525E-02 0.525E-02 0.525E-02 + -2.073 0.364E-01 0.121E-01 0.121E-01 0.121E-01 + -1.973 0.466E-01 0.155E-01 0.155E-01 0.155E-01 + -1.873 0.262E-01 0.873E-02 0.873E-02 0.873E-02 + -1.773 0.413E-01 0.138E-01 0.138E-01 0.138E-01 + -1.673 0.972E-01 0.324E-01 0.324E-01 0.324E-01 + -1.573 0.146E+00 0.485E-01 0.485E-01 0.485E-01 + -1.473 0.101E+00 0.338E-01 0.338E-01 0.338E-01 + -1.373 0.416E-01 0.139E-01 0.139E-01 0.139E-01 + -1.273 0.104E-01 0.346E-02 0.346E-02 0.346E-02 + -1.173 0.447E-01 0.149E-01 0.149E-01 0.149E-01 + -1.073 0.634E-01 0.211E-01 0.211E-01 0.211E-01 + -0.973 0.182E-01 0.606E-02 0.606E-02 0.606E-02 + -0.873 0.633E-01 0.211E-01 0.211E-01 0.211E-01 + -0.773 0.259E+00 0.864E-01 0.864E-01 0.864E-01 + -0.673 0.416E+00 0.139E+00 0.139E+00 0.139E+00 + -0.573 0.453E+00 0.151E+00 0.151E+00 0.151E+00 + -0.473 0.455E+00 0.152E+00 0.152E+00 0.152E+00 + -0.373 0.363E+00 0.121E+00 0.121E+00 0.121E+00 + -0.273 0.104E+00 0.348E-01 0.348E-01 0.348E-01 + -0.173 0.361E-01 0.120E-01 0.120E-01 0.120E-01 + -0.073 0.123E+00 0.410E-01 0.410E-01 0.410E-01 + 0.027 0.259E+00 0.862E-01 0.862E-01 0.862E-01 + 0.127 0.324E+00 0.108E+00 0.108E+00 0.108E+00 + 0.227 0.924E-01 0.308E-01 0.308E-01 0.308E-01 + 0.327 0.682E-02 0.227E-02 0.227E-02 0.227E-02 + 0.427 0.401E-01 0.134E-01 0.134E-01 0.134E-01 + 0.527 0.873E-01 0.291E-01 0.291E-01 0.291E-01 + 0.627 0.110E+00 0.368E-01 0.368E-01 0.368E-01 + 0.727 0.154E+00 0.513E-01 0.513E-01 0.513E-01 + 0.827 0.227E+00 0.756E-01 0.756E-01 0.756E-01 + 0.927 0.207E+00 0.689E-01 0.689E-01 0.689E-01 + 1.027 0.748E-01 0.249E-01 0.249E-01 0.249E-01 + 1.127 0.286E-01 0.952E-02 0.952E-02 0.952E-02 + 1.227 0.125E-01 0.417E-02 0.417E-02 0.417E-02 + 1.327 0.148E-01 0.492E-02 0.492E-02 0.492E-02 + 1.427 0.772E-01 0.257E-01 0.257E-01 0.257E-01 + 1.527 0.669E-01 0.223E-01 0.223E-01 0.223E-01 + 1.627 0.126E+00 0.422E-01 0.422E-01 0.422E-01 + 1.727 0.279E+00 0.928E-01 0.928E-01 0.928E-01 + 1.827 0.299E+00 0.998E-01 0.998E-01 0.998E-01 + 1.927 0.336E+00 0.112E+00 0.112E+00 0.112E+00 + 2.027 0.248E+00 0.828E-01 0.828E-01 0.828E-01 + 2.127 0.497E+00 0.166E+00 0.166E+00 0.166E+00 + 2.227 0.614E+00 0.205E+00 0.205E+00 0.205E+00 + 2.327 0.452E+00 0.151E+00 0.151E+00 0.151E+00 + 2.427 0.529E+00 0.176E+00 0.176E+00 0.176E+00 + 2.527 0.674E+00 0.225E+00 0.225E+00 0.225E+00 + 2.627 0.310E+00 0.103E+00 0.103E+00 0.103E+00 + 2.727 0.162E+00 0.539E-01 0.539E-01 0.539E-01 + 2.827 0.238E+00 0.792E-01 0.792E-01 0.792E-01 + 2.927 0.695E+00 0.232E+00 0.232E+00 0.232E+00 + 3.027 0.845E+00 0.282E+00 0.282E+00 0.282E+00 + 3.127 0.519E+00 0.173E+00 0.173E+00 0.173E+00 + 3.227 0.437E+00 0.146E+00 0.146E+00 0.146E+00 + 3.327 0.692E+00 0.231E+00 0.231E+00 0.231E+00 + 3.427 0.731E+00 0.244E+00 0.244E+00 0.244E+00 + 3.527 0.693E+00 0.231E+00 0.231E+00 0.231E+00 + 3.627 0.578E+00 0.193E+00 0.193E+00 0.193E+00 + 3.727 0.745E+00 0.248E+00 0.248E+00 0.248E+00 + 3.827 0.580E+00 0.193E+00 0.193E+00 0.193E+00 + 3.927 0.452E+00 0.151E+00 0.151E+00 0.151E+00 + 4.027 0.684E+00 0.228E+00 0.228E+00 0.228E+00 + 4.127 0.821E+00 0.274E+00 0.274E+00 0.274E+00 + 4.227 0.596E+00 0.199E+00 0.199E+00 0.199E+00 + 4.327 0.435E+00 0.145E+00 0.145E+00 0.145E+00 + 4.427 0.655E+00 0.218E+00 0.218E+00 0.218E+00 + 4.527 0.741E+00 0.247E+00 0.247E+00 0.247E+00 + 4.627 0.320E+00 0.107E+00 0.107E+00 0.107E+00 + 4.727 0.309E+00 0.103E+00 0.103E+00 0.103E+00 + 4.827 0.781E+00 0.260E+00 0.260E+00 0.260E+00 + 4.927 0.720E+00 0.240E+00 0.240E+00 0.240E+00 + 5.027 0.345E+00 0.115E+00 0.115E+00 0.115E+00 + 5.127 0.242E+00 0.807E-01 0.807E-01 0.807E-01 + 5.227 0.267E+00 0.890E-01 0.890E-01 0.890E-01 + 5.327 0.171E+00 0.569E-01 0.569E-01 0.569E-01 + 5.427 0.298E+00 0.993E-01 0.993E-01 0.993E-01 + 5.527 0.295E+00 0.982E-01 0.982E-01 0.982E-01 + 5.627 0.169E+00 0.563E-01 0.563E-01 0.563E-01 + 5.727 0.181E+00 0.605E-01 0.605E-01 0.605E-01 + 5.827 0.589E-01 0.196E-01 0.196E-01 0.196E-01 + 5.927 0.167E-01 0.558E-02 0.558E-02 0.558E-02 + 6.027 0.678E-01 0.226E-01 0.226E-01 0.226E-01 + 6.127 0.570E-01 0.190E-01 0.190E-01 0.190E-01 + 6.227 0.175E-01 0.584E-02 0.584E-02 0.584E-02 + 6.327 0.178E-02 0.594E-03 0.594E-03 0.594E-03 + 6.427 0.296E-04 0.986E-05 0.986E-05 0.986E-05 + 6.527 0.678E-07 0.226E-07 0.226E-07 0.226E-07 diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#8(Si)_wfc#1(s) b/docs/src/assets/job/Job2/Si.pdos_atm#8(Si)_wfc#1(s) new file mode 100644 index 00000000..7c55f19a --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#8(Si)_wfc#1(s) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) + -3.973 0.134E+00 0.134E+00 + -3.873 0.212E+00 0.212E+00 + -3.773 0.311E+00 0.311E+00 + -3.673 0.260E+00 0.260E+00 + -3.573 0.309E+00 0.309E+00 + -3.473 0.372E+00 0.372E+00 + -3.373 0.215E+00 0.215E+00 + -3.273 0.213E+00 0.213E+00 + -3.173 0.268E+00 0.268E+00 + -3.073 0.318E+00 0.318E+00 + -2.973 0.936E-01 0.936E-01 + -2.873 0.145E+00 0.145E+00 + -2.773 0.317E+00 0.317E+00 + -2.673 0.340E+00 0.340E+00 + -2.573 0.424E+00 0.424E+00 + -2.473 0.164E+00 0.164E+00 + -2.373 0.662E-01 0.662E-01 + -2.273 0.994E-01 0.994E-01 + -2.173 0.323E-01 0.323E-01 + -2.073 0.722E-01 0.722E-01 + -1.973 0.919E-01 0.919E-01 + -1.873 0.468E-01 0.468E-01 + -1.773 0.645E-01 0.645E-01 + -1.673 0.128E+00 0.128E+00 + -1.573 0.195E+00 0.195E+00 + -1.473 0.139E+00 0.139E+00 + -1.373 0.546E-01 0.546E-01 + -1.273 0.130E-01 0.130E-01 + -1.173 0.545E-01 0.545E-01 + -1.073 0.771E-01 0.771E-01 + -0.973 0.178E-01 0.178E-01 + -0.873 0.461E-01 0.461E-01 + -0.773 0.200E+00 0.200E+00 + -0.673 0.325E+00 0.325E+00 + -0.573 0.357E+00 0.357E+00 + -0.473 0.361E+00 0.361E+00 + -0.373 0.315E+00 0.315E+00 + -0.273 0.104E+00 0.104E+00 + -0.173 0.344E-01 0.344E-01 + -0.073 0.970E-01 0.970E-01 + 0.027 0.159E+00 0.159E+00 + 0.127 0.204E+00 0.204E+00 + 0.227 0.592E-01 0.592E-01 + 0.327 0.527E-02 0.527E-02 + 0.427 0.388E-01 0.388E-01 + 0.527 0.830E-01 0.830E-01 + 0.627 0.951E-01 0.951E-01 + 0.727 0.116E+00 0.116E+00 + 0.827 0.133E+00 0.133E+00 + 0.927 0.145E+00 0.145E+00 + 1.027 0.700E-01 0.700E-01 + 1.127 0.258E-01 0.258E-01 + 1.227 0.108E-01 0.108E-01 + 1.327 0.109E-01 0.109E-01 + 1.427 0.562E-01 0.562E-01 + 1.527 0.449E-01 0.449E-01 + 1.627 0.487E-01 0.487E-01 + 1.727 0.105E+00 0.105E+00 + 1.827 0.390E-01 0.390E-01 + 1.927 0.108E-01 0.108E-01 + 2.027 0.141E-01 0.141E-01 + 2.127 0.492E-01 0.492E-01 + 2.227 0.930E-01 0.930E-01 + 2.327 0.538E-01 0.538E-01 + 2.427 0.529E-01 0.529E-01 + 2.527 0.672E-01 0.672E-01 + 2.627 0.597E-01 0.597E-01 + 2.727 0.559E-01 0.559E-01 + 2.827 0.344E-01 0.344E-01 + 2.927 0.461E-01 0.461E-01 + 3.027 0.450E-01 0.450E-01 + 3.127 0.342E-01 0.342E-01 + 3.227 0.177E-01 0.177E-01 + 3.327 0.458E-01 0.458E-01 + 3.427 0.709E-01 0.709E-01 + 3.527 0.447E-01 0.447E-01 + 3.627 0.371E-01 0.371E-01 + 3.727 0.551E-01 0.551E-01 + 3.827 0.264E-01 0.264E-01 + 3.927 0.510E-02 0.510E-02 + 4.027 0.127E-01 0.127E-01 + 4.127 0.364E-01 0.364E-01 + 4.227 0.287E-01 0.287E-01 + 4.327 0.142E-01 0.142E-01 + 4.427 0.209E-01 0.209E-01 + 4.527 0.432E-01 0.432E-01 + 4.627 0.265E-01 0.265E-01 + 4.727 0.437E-02 0.437E-02 + 4.827 0.691E-02 0.691E-02 + 4.927 0.474E-02 0.474E-02 + 5.027 0.706E-03 0.706E-03 + 5.127 0.455E-02 0.455E-02 + 5.227 0.141E-01 0.141E-01 + 5.327 0.830E-02 0.830E-02 + 5.427 0.101E-01 0.101E-01 + 5.527 0.783E-02 0.783E-02 + 5.627 0.884E-03 0.884E-03 + 5.727 0.138E-04 0.138E-04 + 5.827 0.303E-07 0.303E-07 + 5.927 0.504E-09 0.504E-09 + 6.027 0.221E-08 0.221E-08 + 6.127 0.168E-08 0.168E-08 + 6.227 0.392E-09 0.392E-09 + 6.327 0.355E-10 0.355E-10 + 6.427 0.580E-12 0.580E-12 + 6.527 0.133E-14 0.133E-14 diff --git a/docs/src/assets/job/Job2/Si.pdos_atm#8(Si)_wfc#2(p) b/docs/src/assets/job/Job2/Si.pdos_atm#8(Si)_wfc#2(p) new file mode 100644 index 00000000..de897582 --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_atm#8(Si)_wfc#2(p) @@ -0,0 +1,107 @@ +# E (eV) ldos(E) pdos(E) pdos(E) pdos(E) + -3.973 0.489E-01 0.170E-01 0.160E-01 0.160E-01 + -3.873 0.852E-01 0.292E-01 0.280E-01 0.280E-01 + -3.773 0.131E+00 0.450E-01 0.429E-01 0.429E-01 + -3.673 0.104E+00 0.351E-01 0.343E-01 0.343E-01 + -3.573 0.118E+00 0.368E-01 0.405E-01 0.405E-01 + -3.473 0.151E+00 0.459E-01 0.524E-01 0.524E-01 + -3.373 0.835E-01 0.255E-01 0.290E-01 0.290E-01 + -3.273 0.767E-01 0.239E-01 0.264E-01 0.264E-01 + -3.173 0.110E+00 0.340E-01 0.379E-01 0.379E-01 + -3.073 0.141E+00 0.434E-01 0.487E-01 0.487E-01 + -2.973 0.426E-01 0.133E-01 0.146E-01 0.146E-01 + -2.873 0.699E-01 0.233E-01 0.233E-01 0.233E-01 + -2.773 0.154E+00 0.519E-01 0.511E-01 0.511E-01 + -2.673 0.170E+00 0.569E-01 0.565E-01 0.565E-01 + -2.573 0.210E+00 0.696E-01 0.704E-01 0.704E-01 + -2.473 0.791E-01 0.258E-01 0.266E-01 0.266E-01 + -2.373 0.338E-01 0.104E-01 0.117E-01 0.117E-01 + -2.273 0.517E-01 0.158E-01 0.180E-01 0.180E-01 + -2.173 0.167E-01 0.522E-02 0.576E-02 0.576E-02 + -2.073 0.365E-01 0.122E-01 0.122E-01 0.122E-01 + -1.973 0.467E-01 0.156E-01 0.156E-01 0.156E-01 + -1.873 0.258E-01 0.877E-02 0.850E-02 0.850E-02 + -1.773 0.373E-01 0.127E-01 0.123E-01 0.123E-01 + -1.673 0.729E-01 0.243E-01 0.243E-01 0.243E-01 + -1.573 0.105E+00 0.349E-01 0.352E-01 0.352E-01 + -1.473 0.787E-01 0.259E-01 0.264E-01 0.264E-01 + -1.373 0.384E-01 0.127E-01 0.128E-01 0.128E-01 + -1.273 0.103E-01 0.342E-02 0.343E-02 0.343E-02 + -1.173 0.446E-01 0.149E-01 0.149E-01 0.149E-01 + -1.073 0.633E-01 0.211E-01 0.211E-01 0.211E-01 + -0.973 0.183E-01 0.624E-02 0.604E-02 0.604E-02 + -0.873 0.638E-01 0.221E-01 0.209E-01 0.209E-01 + -0.773 0.259E+00 0.879E-01 0.855E-01 0.855E-01 + -0.673 0.413E+00 0.138E+00 0.137E+00 0.137E+00 + -0.573 0.452E+00 0.152E+00 0.150E+00 0.150E+00 + -0.473 0.459E+00 0.154E+00 0.153E+00 0.153E+00 + -0.373 0.358E+00 0.119E+00 0.119E+00 0.119E+00 + -0.273 0.950E-01 0.313E-01 0.318E-01 0.318E-01 + -0.173 0.330E-01 0.109E-01 0.111E-01 0.111E-01 + -0.073 0.118E+00 0.381E-01 0.398E-01 0.398E-01 + 0.027 0.253E+00 0.780E-01 0.873E-01 0.873E-01 + 0.127 0.322E+00 0.987E-01 0.112E+00 0.112E+00 + 0.227 0.926E-01 0.285E-01 0.320E-01 0.320E-01 + 0.327 0.682E-02 0.205E-02 0.238E-02 0.238E-02 + 0.427 0.399E-01 0.115E-01 0.142E-01 0.142E-01 + 0.527 0.870E-01 0.256E-01 0.307E-01 0.307E-01 + 0.627 0.112E+00 0.382E-01 0.369E-01 0.369E-01 + 0.727 0.155E+00 0.548E-01 0.499E-01 0.499E-01 + 0.827 0.222E+00 0.736E-01 0.744E-01 0.744E-01 + 0.927 0.204E+00 0.663E-01 0.687E-01 0.687E-01 + 1.027 0.722E-01 0.239E-01 0.242E-01 0.242E-01 + 1.127 0.189E-01 0.630E-02 0.629E-02 0.629E-02 + 1.227 0.719E-02 0.240E-02 0.239E-02 0.239E-02 + 1.327 0.150E-01 0.500E-02 0.499E-02 0.499E-02 + 1.427 0.805E-01 0.269E-01 0.268E-01 0.268E-01 + 1.527 0.695E-01 0.234E-01 0.230E-01 0.230E-01 + 1.627 0.128E+00 0.459E-01 0.410E-01 0.410E-01 + 1.727 0.280E+00 0.101E+00 0.898E-01 0.898E-01 + 1.827 0.303E+00 0.103E+00 0.996E-01 0.996E-01 + 1.927 0.347E+00 0.115E+00 0.116E+00 0.116E+00 + 2.027 0.260E+00 0.859E-01 0.869E-01 0.869E-01 + 2.127 0.504E+00 0.168E+00 0.168E+00 0.168E+00 + 2.227 0.617E+00 0.204E+00 0.206E+00 0.206E+00 + 2.327 0.458E+00 0.152E+00 0.153E+00 0.153E+00 + 2.427 0.547E+00 0.184E+00 0.181E+00 0.181E+00 + 2.527 0.701E+00 0.243E+00 0.229E+00 0.229E+00 + 2.627 0.306E+00 0.107E+00 0.996E-01 0.996E-01 + 2.727 0.147E+00 0.478E-01 0.497E-01 0.497E-01 + 2.827 0.236E+00 0.721E-01 0.819E-01 0.819E-01 + 2.927 0.693E+00 0.219E+00 0.237E+00 0.237E+00 + 3.027 0.837E+00 0.279E+00 0.279E+00 0.279E+00 + 3.127 0.518E+00 0.180E+00 0.169E+00 0.169E+00 + 3.227 0.437E+00 0.150E+00 0.143E+00 0.143E+00 + 3.327 0.699E+00 0.236E+00 0.232E+00 0.232E+00 + 3.427 0.740E+00 0.255E+00 0.243E+00 0.243E+00 + 3.527 0.691E+00 0.248E+00 0.222E+00 0.222E+00 + 3.627 0.555E+00 0.192E+00 0.182E+00 0.182E+00 + 3.727 0.721E+00 0.233E+00 0.244E+00 0.244E+00 + 3.827 0.588E+00 0.190E+00 0.199E+00 0.199E+00 + 3.927 0.448E+00 0.147E+00 0.151E+00 0.151E+00 + 4.027 0.664E+00 0.228E+00 0.218E+00 0.218E+00 + 4.127 0.820E+00 0.281E+00 0.269E+00 0.269E+00 + 4.227 0.614E+00 0.211E+00 0.201E+00 0.201E+00 + 4.327 0.437E+00 0.150E+00 0.143E+00 0.143E+00 + 4.427 0.634E+00 0.213E+00 0.210E+00 0.210E+00 + 4.527 0.726E+00 0.238E+00 0.244E+00 0.244E+00 + 4.627 0.320E+00 0.104E+00 0.108E+00 0.108E+00 + 4.727 0.307E+00 0.105E+00 0.101E+00 0.101E+00 + 4.827 0.810E+00 0.269E+00 0.270E+00 0.270E+00 + 4.927 0.755E+00 0.254E+00 0.251E+00 0.251E+00 + 5.027 0.353E+00 0.120E+00 0.117E+00 0.117E+00 + 5.127 0.237E+00 0.806E-01 0.784E-01 0.784E-01 + 5.227 0.263E+00 0.886E-01 0.873E-01 0.873E-01 + 5.327 0.170E+00 0.566E-01 0.565E-01 0.565E-01 + 5.427 0.293E+00 0.976E-01 0.976E-01 0.976E-01 + 5.527 0.285E+00 0.956E-01 0.949E-01 0.949E-01 + 5.627 0.160E+00 0.543E-01 0.530E-01 0.530E-01 + 5.727 0.179E+00 0.600E-01 0.597E-01 0.597E-01 + 5.827 0.589E-01 0.196E-01 0.196E-01 0.196E-01 + 5.927 0.167E-01 0.558E-02 0.558E-02 0.558E-02 + 6.027 0.675E-01 0.225E-01 0.225E-01 0.225E-01 + 6.127 0.555E-01 0.183E-01 0.186E-01 0.186E-01 + 6.227 0.161E-01 0.517E-02 0.546E-02 0.546E-02 + 6.327 0.160E-02 0.510E-03 0.547E-03 0.547E-03 + 6.427 0.265E-04 0.844E-05 0.906E-05 0.906E-05 + 6.527 0.608E-07 0.193E-07 0.207E-07 0.207E-07 diff --git a/docs/src/assets/job/Job2/Si.pdos_tot b/docs/src/assets/job/Job2/Si.pdos_tot new file mode 100644 index 00000000..187328e2 --- /dev/null +++ b/docs/src/assets/job/Job2/Si.pdos_tot @@ -0,0 +1,107 @@ +# E (eV) dos(E) pdos(E) + -3.973 0.150E+01 0.147E+01 + -3.873 0.246E+01 0.238E+01 + -3.773 0.365E+01 0.354E+01 + -3.673 0.299E+01 0.293E+01 + -3.573 0.350E+01 0.345E+01 + -3.473 0.429E+01 0.422E+01 + -3.373 0.243E+01 0.240E+01 + -3.273 0.231E+01 0.231E+01 + -3.173 0.301E+01 0.299E+01 + -3.073 0.366E+01 0.362E+01 + -2.973 0.111E+01 0.108E+01 + -2.873 0.181E+01 0.173E+01 + -2.773 0.389E+01 0.380E+01 + -2.673 0.414E+01 0.409E+01 + -2.573 0.511E+01 0.506E+01 + -2.473 0.195E+01 0.193E+01 + -2.373 0.800E+00 0.781E+00 + -2.273 0.121E+01 0.118E+01 + -2.173 0.394E+00 0.386E+00 + -2.073 0.874E+00 0.870E+00 + -1.973 0.111E+01 0.111E+01 + -1.873 0.586E+00 0.584E+00 + -1.773 0.840E+00 0.834E+00 + -1.673 0.173E+01 0.170E+01 + -1.573 0.260E+01 0.256E+01 + -1.473 0.186E+01 0.183E+01 + -1.373 0.762E+00 0.754E+00 + -1.273 0.188E+00 0.187E+00 + -1.173 0.797E+00 0.792E+00 + -1.073 0.113E+01 0.112E+01 + -0.973 0.290E+00 0.288E+00 + -0.873 0.883E+00 0.875E+00 + -0.773 0.371E+01 0.368E+01 + -0.673 0.597E+01 0.592E+01 + -0.573 0.653E+01 0.647E+01 + -0.473 0.657E+01 0.652E+01 + -0.373 0.544E+01 0.539E+01 + -0.273 0.165E+01 0.163E+01 + -0.173 0.561E+00 0.557E+00 + -0.073 0.177E+01 0.176E+01 + 0.027 0.336E+01 0.334E+01 + 0.127 0.426E+01 0.422E+01 + 0.227 0.122E+01 0.121E+01 + 0.327 0.976E-01 0.967E-01 + 0.427 0.638E+00 0.631E+00 + 0.527 0.138E+01 0.136E+01 + 0.627 0.167E+01 0.164E+01 + 0.727 0.220E+01 0.216E+01 + 0.827 0.294E+01 0.288E+01 + 0.927 0.288E+01 0.281E+01 + 1.027 0.118E+01 0.115E+01 + 1.127 0.412E+00 0.396E+00 + 1.227 0.172E+00 0.165E+00 + 1.327 0.211E+00 0.204E+00 + 1.427 0.110E+01 0.107E+01 + 1.527 0.933E+00 0.895E+00 + 1.627 0.152E+01 0.140E+01 + 1.727 0.333E+01 0.307E+01 + 1.827 0.313E+01 0.271E+01 + 1.927 0.314E+01 0.277E+01 + 2.027 0.220E+01 0.210E+01 + 2.127 0.459E+01 0.437E+01 + 2.227 0.597E+01 0.564E+01 + 2.327 0.422E+01 0.404E+01 + 2.427 0.483E+01 0.467E+01 + 2.527 0.613E+01 0.594E+01 + 2.627 0.292E+01 0.294E+01 + 2.727 0.163E+01 0.173E+01 + 2.827 0.217E+01 0.217E+01 + 2.927 0.605E+01 0.591E+01 + 3.027 0.740E+01 0.711E+01 + 3.127 0.464E+01 0.442E+01 + 3.227 0.373E+01 0.364E+01 + 3.327 0.601E+01 0.593E+01 + 3.427 0.660E+01 0.646E+01 + 3.527 0.609E+01 0.591E+01 + 3.627 0.503E+01 0.491E+01 + 3.727 0.653E+01 0.637E+01 + 3.827 0.491E+01 0.484E+01 + 3.927 0.372E+01 0.366E+01 + 4.027 0.568E+01 0.559E+01 + 4.127 0.695E+01 0.689E+01 + 4.227 0.506E+01 0.501E+01 + 4.327 0.366E+01 0.359E+01 + 4.427 0.552E+01 0.540E+01 + 4.527 0.636E+01 0.627E+01 + 4.627 0.280E+01 0.277E+01 + 4.727 0.257E+01 0.250E+01 + 4.827 0.641E+01 0.631E+01 + 4.927 0.592E+01 0.580E+01 + 5.027 0.284E+01 0.277E+01 + 5.127 0.200E+01 0.197E+01 + 5.227 0.228E+01 0.225E+01 + 5.327 0.147E+01 0.143E+01 + 5.427 0.247E+01 0.245E+01 + 5.527 0.242E+01 0.240E+01 + 5.627 0.142E+01 0.136E+01 + 5.727 0.159E+01 0.145E+01 + 5.827 0.519E+00 0.472E+00 + 5.927 0.148E+00 0.134E+00 + 6.027 0.599E+00 0.541E+00 + 6.127 0.499E+00 0.451E+00 + 6.227 0.150E+00 0.136E+00 + 6.327 0.151E-01 0.137E-01 + 6.427 0.250E-03 0.227E-03 + 6.527 0.573E-06 0.520E-06 diff --git a/docs/src/assets/job/Job2/bands.in b/docs/src/assets/job/Job2/bands.in new file mode 100644 index 00000000..1c6f90a0 --- /dev/null +++ b/docs/src/assets/job/Job2/bands.in @@ -0,0 +1,52 @@ +&control + prefix = 'Si' + verbosity = 'high' + calculation = 'bands' + outdir = '/home/ponet/.julia/dev/DFControl/docs/src/assets/job/outputs' + pseudo_dir = '/home/ponet/Documents/pseudos/pslibrary_pbesol/PSEUDOPOTENTIALS' +/ + +&system + ibrav = 0 + nat = 8 + ntyp = 1 + ecutwfc = 20.0 +/ + +&electrons + conv_thr = 1.0e-6 +/ + +ATOMIC_SPECIES +Si 28.0855 Si.pbesol-n-kjpaw_psl.0.1.UPF + +CELL_PARAMETERS (angstrom) +5.4309401512146 0.0 0.0 +0.0 5.4309401512146 0.0 +0.0 0.0 5.4309401512146 + +ATOMIC_POSITIONS (crystal) +Si 0.0 0.0 0.0 +Si 0.0 0.5 0.5 +Si 0.25 0.25 0.25 +Si 0.5 0.0 0.5 +Si 0.25 0.75 0.75 +Si 0.75 0.75 0.25 +Si 0.75 0.25 0.75 +Si 0.5 0.5 0.0 + +K_POINTS (crystal_b) +12 + 0.0 0.0 0.0 20.0 + 0.5 0.0 0.5 20.0 + 0.5 0.25 0.75 20.0 + 0.375 0.375 0.75 20.0 + 0.0 0.0 0.0 20.0 + 0.5 0.5 0.5 20.0 + 0.625 0.25 0.625 20.0 + 0.5 0.25 0.75 20.0 + 0.5 0.5 0.5 20.0 + 0.375 0.375 0.75 20.0 + 0.625 0.25 0.625 20.0 + 0.5 0.0 0.5 1.0 + diff --git a/docs/src/assets/job/Job2/bands.out b/docs/src/assets/job/Job2/bands.out new file mode 100644 index 00000000..6f01af87 --- /dev/null +++ b/docs/src/assets/job/Job2/bands.out @@ -0,0 +1,2216 @@ + + Program PWSCF v.6.7GPU starts on 16Jun2021 at 0:13:36 + + This program is part of the open-source Quantum ESPRESSO suite + for quantum simulation of materials; please cite + "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); + "P. Giannozzi et al., J. Phys.:Condens. Matter 29 465901 (2017); + "P. Giannozzi et al., J. Chem. Phys. 152 154105 (2020); + URL http://www.quantum-espresso.org", + in publications or presentations arising from this work. More details at + http://www.quantum-espresso.org/quote + + Parallel version (MPI), running on 4 processors + + MPI processes distributed on 1 nodes + K-points division: npool = 4 + Waiting for input... + Reading input from standard input + + Current dimensions of program PWSCF are: + Max number of different atomic species (ntypx) = 10 + Max number of k-points (npk) = 40000 + Max angular momentum in pseudopotentials (lmaxx) = 3 + + Atomic positions and unit cell read from directory: + /home/ponet/.julia/environments/DFControlDEV/outputs/Si.save/ + + file Si.pbesol-n-kjpaw_psl.0.1.UPF: wavefunction(s) 3S renormalized + Found symmetry operation: I + ( 0.0000 -0.5000 -0.5000) + This is a supercell, fractional translations are disabled + Message from routine setup: + using ibrav=0 with symmetry is DISCOURAGED, use correct ibrav instead + + Subspace diagonalization in iterative solution of the eigenvalue problem: + a serial algorithm will be used + + + G-vector sticks info + -------------------- + sticks: dense smooth PW G-vecs: dense smooth PW + Sum 673 673 213 13133 13133 2325 + + Using Slab Decomposition + + + + bravais-lattice index = 0 + lattice parameter (alat) = 10.2630 a.u. + unit-cell volume = 1080.9899 (a.u.)^3 + number of atoms/cell = 8 + number of atomic types = 1 + number of electrons = 32.00 + number of Kohn-Sham states= 16 + kinetic-energy cutoff = 20.0000 Ry + charge density cutoff = 80.0000 Ry + Exchange-correlation= SLA PW PSX PSC + ( 1 4 10 8 0 0 0) + + celldm(1)= 10.262989 celldm(2)= 0.000000 celldm(3)= 0.000000 + celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 + + crystal axes: (cart. coord. in units of alat) + a(1) = ( 1.000000 0.000000 0.000000 ) + a(2) = ( 0.000000 1.000000 0.000000 ) + a(3) = ( 0.000000 0.000000 1.000000 ) + + reciprocal axes: (cart. coord. in units 2 pi/alat) + b(1) = ( 1.000000 0.000000 0.000000 ) + b(2) = ( 0.000000 1.000000 0.000000 ) + b(3) = ( 0.000000 0.000000 1.000000 ) + + + PseudoPot. # 1 for Si read from file: + /home/ponet/Documents/pseudos/pslibrary_pbesol/PSEUDOPOTENTIALS/Si.pbesol-n-kjpaw_psl.0.1.UPF + MD5 check sum: e112a9414d22b310a654c074e8da067c + Pseudo is Projector augmented-wave + core cor, Zval = 4.0 + Generated using "atomic" code by A. Dal Corso v.5.0.99 svn rev. 10869 + Shape of augmentation charge: PSQ + Using radial grid of 1141 points, 4 beta functions with: + l(1) = 0 + l(2) = 0 + l(3) = 1 + l(4) = 1 + Q(r) pseudized with 0 coefficients + + + atomic species valence mass pseudopotential + Si 4.00 28.08550 Si( 1.00) + + 24 Sym. Ops. (no inversion) found + + + s frac. trans. + + isym = 1 identity + + cryst. s( 1) = ( 1 0 0 ) + ( 0 1 0 ) + ( 0 0 1 ) + + cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + + + isym = 2 180 deg rotation - cart. axis [0,0,1] + + cryst. s( 2) = ( -1 0 0 ) + ( 0 -1 0 ) + ( 0 0 1 ) + + cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + + + isym = 3 180 deg rotation - cart. axis [0,1,0] + + cryst. s( 3) = ( -1 0 0 ) + ( 0 1 0 ) + ( 0 0 -1 ) + + cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + + + isym = 4 180 deg rotation - cart. axis [1,0,0] + + cryst. s( 4) = ( 1 0 0 ) + ( 0 -1 0 ) + ( 0 0 -1 ) + + cart. s( 4) = ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + + + isym = 5 120 deg rotation - cart. axis [-1,-1,-1] + + cryst. s( 5) = ( 0 0 1 ) + ( 1 0 0 ) + ( 0 1 0 ) + + cart. s( 5) = ( 0.0000000 1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + + + isym = 6 120 deg rotation - cart. axis [-1,1,1] + + cryst. s( 6) = ( 0 0 -1 ) + ( -1 0 0 ) + ( 0 1 0 ) + + cart. s( 6) = ( 0.0000000 -1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + + + isym = 7 120 deg rotation - cart. axis [1,1,-1] + + cryst. s( 7) = ( 0 0 -1 ) + ( 1 0 0 ) + ( 0 -1 0 ) + + cart. s( 7) = ( 0.0000000 1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + + + isym = 8 120 deg rotation - cart. axis [1,-1,1] + + cryst. s( 8) = ( 0 0 1 ) + ( -1 0 0 ) + ( 0 -1 0 ) + + cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + + + isym = 9 120 deg rotation - cart. axis [1,1,1] + + cryst. s( 9) = ( 0 1 0 ) + ( 0 0 1 ) + ( 1 0 0 ) + + cart. s( 9) = ( 0.0000000 0.0000000 1.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + + + isym = 10 120 deg rotation - cart. axis [-1,1,-1] + + cryst. s(10) = ( 0 -1 0 ) + ( 0 0 -1 ) + ( 1 0 0 ) + + cart. s(10) = ( 0.0000000 0.0000000 1.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + + + isym = 11 120 deg rotation - cart. axis [1,-1,-1] + + cryst. s(11) = ( 0 -1 0 ) + ( 0 0 1 ) + ( -1 0 0 ) + + cart. s(11) = ( 0.0000000 0.0000000 -1.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + + + isym = 12 120 deg rotation - cart. axis [-1,-1,1] + + cryst. s(12) = ( 0 1 0 ) + ( 0 0 -1 ) + ( -1 0 0 ) + + cart. s(12) = ( 0.0000000 0.0000000 -1.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + + + isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] + + cryst. s(13) = ( 0 -1 0 ) + ( -1 0 0 ) + ( 0 0 1 ) + + cart. s(13) = ( 0.0000000 -1.0000000 0.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + + + isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] + + cryst. s(14) = ( 0 1 0 ) + ( 1 0 0 ) + ( 0 0 1 ) + + cart. s(14) = ( 0.0000000 1.0000000 0.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + + + isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] + + cryst. s(15) = ( 0 1 0 ) + ( -1 0 0 ) + ( 0 0 -1 ) + + cart. s(15) = ( 0.0000000 -1.0000000 0.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + + + isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] + + cryst. s(16) = ( 0 -1 0 ) + ( 1 0 0 ) + ( 0 0 -1 ) + + cart. s(16) = ( 0.0000000 1.0000000 0.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + + + isym = 17 inv. 180 deg rotation - cart. axis [1,0,1] + + cryst. s(17) = ( 0 0 -1 ) + ( 0 1 0 ) + ( -1 0 0 ) + + cart. s(17) = ( 0.0000000 0.0000000 -1.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + + + isym = 18 inv. 180 deg rotation - cart. axis [-1,0,1] + + cryst. s(18) = ( 0 0 1 ) + ( 0 1 0 ) + ( 1 0 0 ) + + cart. s(18) = ( 0.0000000 0.0000000 1.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + + + isym = 19 inv. 90 deg rotation - cart. axis [0,1,0] + + cryst. s(19) = ( 0 0 1 ) + ( 0 -1 0 ) + ( -1 0 0 ) + + cart. s(19) = ( 0.0000000 0.0000000 -1.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + + + isym = 20 inv. 90 deg rotation - cart. axis [0,-1,0] + + cryst. s(20) = ( 0 0 -1 ) + ( 0 -1 0 ) + ( 1 0 0 ) + + cart. s(20) = ( 0.0000000 0.0000000 1.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + + + isym = 21 inv. 180 deg rotation - cart. axis [0,1,1] + + cryst. s(21) = ( 1 0 0 ) + ( 0 0 -1 ) + ( 0 -1 0 ) + + cart. s(21) = ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + + + isym = 22 inv. 180 deg rotation - cart. axis [0,1,-1] + + cryst. s(22) = ( 1 0 0 ) + ( 0 0 1 ) + ( 0 1 0 ) + + cart. s(22) = ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + + + isym = 23 inv. 90 deg rotation - cart. axis [-1,0,0] + + cryst. s(23) = ( -1 0 0 ) + ( 0 0 1 ) + ( 0 -1 0 ) + + cart. s(23) = ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + + + isym = 24 inv. 90 deg rotation - cart. axis [1,0,0] + + cryst. s(24) = ( -1 0 0 ) + ( 0 0 -1 ) + ( 0 1 0 ) + + cart. s(24) = ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + + + Cartesian axes + + site n. atom positions (alat units) + 1 Si tau( 1) = ( 0.0000000 0.0000000 0.0000000 ) + 2 Si tau( 2) = ( 0.0000000 0.5000000 0.5000000 ) + 3 Si tau( 3) = ( 0.2500000 0.2500000 0.2500000 ) + 4 Si tau( 4) = ( 0.5000000 0.0000000 0.5000000 ) + 5 Si tau( 5) = ( 0.2500000 0.7500000 0.7500000 ) + 6 Si tau( 6) = ( 0.7500000 0.7500000 0.2500000 ) + 7 Si tau( 7) = ( 0.7500000 0.2500000 0.7500000 ) + 8 Si tau( 8) = ( 0.5000000 0.5000000 0.0000000 ) + + Crystallographic axes + + site n. atom positions (cryst. coord.) + 1 Si tau( 1) = ( 0.0000000 0.0000000 0.0000000 ) + 2 Si tau( 2) = ( 0.0000000 0.5000000 0.5000000 ) + 3 Si tau( 3) = ( 0.2500000 0.2500000 0.2500000 ) + 4 Si tau( 4) = ( 0.5000000 0.0000000 0.5000000 ) + 5 Si tau( 5) = ( 0.2500000 0.7500000 0.7500000 ) + 6 Si tau( 6) = ( 0.7500000 0.7500000 0.2500000 ) + 7 Si tau( 7) = ( 0.7500000 0.2500000 0.7500000 ) + 8 Si tau( 8) = ( 0.5000000 0.5000000 0.0000000 ) + + number of k points= 221 + cart. coord. in units 2pi/alat + k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0090498 + k( 2) = ( 0.0250000 0.0000000 0.0250000), wk = 0.0090498 + k( 3) = ( 0.0500000 0.0000000 0.0500000), wk = 0.0090498 + k( 4) = ( 0.0750000 0.0000000 0.0750000), wk = 0.0090498 + k( 5) = ( 0.1000000 0.0000000 0.1000000), wk = 0.0090498 + k( 6) = ( 0.1250000 0.0000000 0.1250000), wk = 0.0090498 + k( 7) = ( 0.1500000 0.0000000 0.1500000), wk = 0.0090498 + k( 8) = ( 0.1750000 0.0000000 0.1750000), wk = 0.0090498 + k( 9) = ( 0.2000000 0.0000000 0.2000000), wk = 0.0090498 + k( 10) = ( 0.2250000 0.0000000 0.2250000), wk = 0.0090498 + k( 11) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0090498 + k( 12) = ( 0.2750000 0.0000000 0.2750000), wk = 0.0090498 + k( 13) = ( 0.3000000 0.0000000 0.3000000), wk = 0.0090498 + k( 14) = ( 0.3250000 0.0000000 0.3250000), wk = 0.0090498 + k( 15) = ( 0.3500000 0.0000000 0.3500000), wk = 0.0090498 + k( 16) = ( 0.3750000 0.0000000 0.3750000), wk = 0.0090498 + k( 17) = ( 0.4000000 0.0000000 0.4000000), wk = 0.0090498 + k( 18) = ( 0.4250000 0.0000000 0.4250000), wk = 0.0090498 + k( 19) = ( 0.4500000 0.0000000 0.4500000), wk = 0.0090498 + k( 20) = ( 0.4750000 0.0000000 0.4750000), wk = 0.0090498 + k( 21) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0090498 + k( 22) = ( 0.5000000 0.0125000 0.5125000), wk = 0.0090498 + k( 23) = ( 0.5000000 0.0250000 0.5250000), wk = 0.0090498 + k( 24) = ( 0.5000000 0.0375000 0.5375000), wk = 0.0090498 + k( 25) = ( 0.5000000 0.0500000 0.5500000), wk = 0.0090498 + k( 26) = ( 0.5000000 0.0625000 0.5625000), wk = 0.0090498 + k( 27) = ( 0.5000000 0.0750000 0.5750000), wk = 0.0090498 + k( 28) = ( 0.5000000 0.0875000 0.5875000), wk = 0.0090498 + k( 29) = ( 0.5000000 0.1000000 0.6000000), wk = 0.0090498 + k( 30) = ( 0.5000000 0.1125000 0.6125000), wk = 0.0090498 + k( 31) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0090498 + k( 32) = ( 0.5000000 0.1375000 0.6375000), wk = 0.0090498 + k( 33) = ( 0.5000000 0.1500000 0.6500000), wk = 0.0090498 + k( 34) = ( 0.5000000 0.1625000 0.6625000), wk = 0.0090498 + k( 35) = ( 0.5000000 0.1750000 0.6750000), wk = 0.0090498 + k( 36) = ( 0.5000000 0.1875000 0.6875000), wk = 0.0090498 + k( 37) = ( 0.5000000 0.2000000 0.7000000), wk = 0.0090498 + k( 38) = ( 0.5000000 0.2125000 0.7125000), wk = 0.0090498 + k( 39) = ( 0.5000000 0.2250000 0.7250000), wk = 0.0090498 + k( 40) = ( 0.5000000 0.2375000 0.7375000), wk = 0.0090498 + k( 41) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0090498 + k( 42) = ( 0.4937500 0.2562500 0.7500000), wk = 0.0090498 + k( 43) = ( 0.4875000 0.2625000 0.7500000), wk = 0.0090498 + k( 44) = ( 0.4812500 0.2687500 0.7500000), wk = 0.0090498 + k( 45) = ( 0.4750000 0.2750000 0.7500000), wk = 0.0090498 + k( 46) = ( 0.4687500 0.2812500 0.7500000), wk = 0.0090498 + k( 47) = ( 0.4625000 0.2875000 0.7500000), wk = 0.0090498 + k( 48) = ( 0.4562500 0.2937500 0.7500000), wk = 0.0090498 + k( 49) = ( 0.4500000 0.3000000 0.7500000), wk = 0.0090498 + k( 50) = ( 0.4437500 0.3062500 0.7500000), wk = 0.0090498 + k( 51) = ( 0.4375000 0.3125000 0.7500000), wk = 0.0090498 + k( 52) = ( 0.4312500 0.3187500 0.7500000), wk = 0.0090498 + k( 53) = ( 0.4250000 0.3250000 0.7500000), wk = 0.0090498 + k( 54) = ( 0.4187500 0.3312500 0.7500000), wk = 0.0090498 + k( 55) = ( 0.4125000 0.3375000 0.7500000), wk = 0.0090498 + k( 56) = ( 0.4062500 0.3437500 0.7500000), wk = 0.0090498 + k( 57) = ( 0.4000000 0.3500000 0.7500000), wk = 0.0090498 + k( 58) = ( 0.3937500 0.3562500 0.7500000), wk = 0.0090498 + k( 59) = ( 0.3875000 0.3625000 0.7500000), wk = 0.0090498 + k( 60) = ( 0.3812500 0.3687500 0.7500000), wk = 0.0090498 + k( 61) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0090498 + k( 62) = ( 0.3562500 0.3562500 0.7125000), wk = 0.0090498 + k( 63) = ( 0.3375000 0.3375000 0.6750000), wk = 0.0090498 + k( 64) = ( 0.3187500 0.3187500 0.6375000), wk = 0.0090498 + k( 65) = ( 0.3000000 0.3000000 0.6000000), wk = 0.0090498 + k( 66) = ( 0.2812500 0.2812500 0.5625000), wk = 0.0090498 + k( 67) = ( 0.2625000 0.2625000 0.5250000), wk = 0.0090498 + k( 68) = ( 0.2437500 0.2437500 0.4875000), wk = 0.0090498 + k( 69) = ( 0.2250000 0.2250000 0.4500000), wk = 0.0090498 + k( 70) = ( 0.2062500 0.2062500 0.4125000), wk = 0.0090498 + k( 71) = ( 0.1875000 0.1875000 0.3750000), wk = 0.0090498 + k( 72) = ( 0.1687500 0.1687500 0.3375000), wk = 0.0090498 + k( 73) = ( 0.1500000 0.1500000 0.3000000), wk = 0.0090498 + k( 74) = ( 0.1312500 0.1312500 0.2625000), wk = 0.0090498 + k( 75) = ( 0.1125000 0.1125000 0.2250000), wk = 0.0090498 + k( 76) = ( 0.0937500 0.0937500 0.1875000), wk = 0.0090498 + k( 77) = ( 0.0750000 0.0750000 0.1500000), wk = 0.0090498 + k( 78) = ( 0.0562500 0.0562500 0.1125000), wk = 0.0090498 + k( 79) = ( 0.0375000 0.0375000 0.0750000), wk = 0.0090498 + k( 80) = ( 0.0187500 0.0187500 0.0375000), wk = 0.0090498 + k( 81) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0090498 + k( 82) = ( 0.0250000 0.0250000 0.0250000), wk = 0.0090498 + k( 83) = ( 0.0500000 0.0500000 0.0500000), wk = 0.0090498 + k( 84) = ( 0.0750000 0.0750000 0.0750000), wk = 0.0090498 + k( 85) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0090498 + k( 86) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0090498 + k( 87) = ( 0.1500000 0.1500000 0.1500000), wk = 0.0090498 + k( 88) = ( 0.1750000 0.1750000 0.1750000), wk = 0.0090498 + k( 89) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0090498 + k( 90) = ( 0.2250000 0.2250000 0.2250000), wk = 0.0090498 + k( 91) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0090498 + k( 92) = ( 0.2750000 0.2750000 0.2750000), wk = 0.0090498 + k( 93) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0090498 + k( 94) = ( 0.3250000 0.3250000 0.3250000), wk = 0.0090498 + k( 95) = ( 0.3500000 0.3500000 0.3500000), wk = 0.0090498 + k( 96) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0090498 + k( 97) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0090498 + k( 98) = ( 0.4250000 0.4250000 0.4250000), wk = 0.0090498 + k( 99) = ( 0.4500000 0.4500000 0.4500000), wk = 0.0090498 + k( 100) = ( 0.4750000 0.4750000 0.4750000), wk = 0.0090498 + k( 101) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0090498 + k( 102) = ( 0.5062500 0.4875000 0.5062500), wk = 0.0090498 + k( 103) = ( 0.5125000 0.4750000 0.5125000), wk = 0.0090498 + k( 104) = ( 0.5187500 0.4625000 0.5187500), wk = 0.0090498 + k( 105) = ( 0.5250000 0.4500000 0.5250000), wk = 0.0090498 + k( 106) = ( 0.5312500 0.4375000 0.5312500), wk = 0.0090498 + k( 107) = ( 0.5375000 0.4250000 0.5375000), wk = 0.0090498 + k( 108) = ( 0.5437500 0.4125000 0.5437500), wk = 0.0090498 + k( 109) = ( 0.5500000 0.4000000 0.5500000), wk = 0.0090498 + k( 110) = ( 0.5562500 0.3875000 0.5562500), wk = 0.0090498 + k( 111) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0090498 + k( 112) = ( 0.5687500 0.3625000 0.5687500), wk = 0.0090498 + k( 113) = ( 0.5750000 0.3500000 0.5750000), wk = 0.0090498 + k( 114) = ( 0.5812500 0.3375000 0.5812500), wk = 0.0090498 + k( 115) = ( 0.5875000 0.3250000 0.5875000), wk = 0.0090498 + k( 116) = ( 0.5937500 0.3125000 0.5937500), wk = 0.0090498 + k( 117) = ( 0.6000000 0.3000000 0.6000000), wk = 0.0090498 + k( 118) = ( 0.6062500 0.2875000 0.6062500), wk = 0.0090498 + k( 119) = ( 0.6125000 0.2750000 0.6125000), wk = 0.0090498 + k( 120) = ( 0.6187500 0.2625000 0.6187500), wk = 0.0090498 + k( 121) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0090498 + k( 122) = ( 0.6187500 0.2500000 0.6312500), wk = 0.0090498 + k( 123) = ( 0.6125000 0.2500000 0.6375000), wk = 0.0090498 + k( 124) = ( 0.6062500 0.2500000 0.6437500), wk = 0.0090498 + k( 125) = ( 0.6000000 0.2500000 0.6500000), wk = 0.0090498 + k( 126) = ( 0.5937500 0.2500000 0.6562500), wk = 0.0090498 + k( 127) = ( 0.5875000 0.2500000 0.6625000), wk = 0.0090498 + k( 128) = ( 0.5812500 0.2500000 0.6687500), wk = 0.0090498 + k( 129) = ( 0.5750000 0.2500000 0.6750000), wk = 0.0090498 + k( 130) = ( 0.5687500 0.2500000 0.6812500), wk = 0.0090498 + k( 131) = ( 0.5625000 0.2500000 0.6875000), wk = 0.0090498 + k( 132) = ( 0.5562500 0.2500000 0.6937500), wk = 0.0090498 + k( 133) = ( 0.5500000 0.2500000 0.7000000), wk = 0.0090498 + k( 134) = ( 0.5437500 0.2500000 0.7062500), wk = 0.0090498 + k( 135) = ( 0.5375000 0.2500000 0.7125000), wk = 0.0090498 + k( 136) = ( 0.5312500 0.2500000 0.7187500), wk = 0.0090498 + k( 137) = ( 0.5250000 0.2500000 0.7250000), wk = 0.0090498 + k( 138) = ( 0.5187500 0.2500000 0.7312500), wk = 0.0090498 + k( 139) = ( 0.5125000 0.2500000 0.7375000), wk = 0.0090498 + k( 140) = ( 0.5062500 0.2500000 0.7437500), wk = 0.0090498 + k( 141) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0090498 + k( 142) = ( 0.5000000 0.2625000 0.7375000), wk = 0.0090498 + k( 143) = ( 0.5000000 0.2750000 0.7250000), wk = 0.0090498 + k( 144) = ( 0.5000000 0.2875000 0.7125000), wk = 0.0090498 + k( 145) = ( 0.5000000 0.3000000 0.7000000), wk = 0.0090498 + k( 146) = ( 0.5000000 0.3125000 0.6875000), wk = 0.0090498 + k( 147) = ( 0.5000000 0.3250000 0.6750000), wk = 0.0090498 + k( 148) = ( 0.5000000 0.3375000 0.6625000), wk = 0.0090498 + k( 149) = ( 0.5000000 0.3500000 0.6500000), wk = 0.0090498 + k( 150) = ( 0.5000000 0.3625000 0.6375000), wk = 0.0090498 + k( 151) = ( 0.5000000 0.3750000 0.6250000), wk = 0.0090498 + k( 152) = ( 0.5000000 0.3875000 0.6125000), wk = 0.0090498 + k( 153) = ( 0.5000000 0.4000000 0.6000000), wk = 0.0090498 + k( 154) = ( 0.5000000 0.4125000 0.5875000), wk = 0.0090498 + k( 155) = ( 0.5000000 0.4250000 0.5750000), wk = 0.0090498 + k( 156) = ( 0.5000000 0.4375000 0.5625000), wk = 0.0090498 + k( 157) = ( 0.5000000 0.4500000 0.5500000), wk = 0.0090498 + k( 158) = ( 0.5000000 0.4625000 0.5375000), wk = 0.0090498 + k( 159) = ( 0.5000000 0.4750000 0.5250000), wk = 0.0090498 + k( 160) = ( 0.5000000 0.4875000 0.5125000), wk = 0.0090498 + k( 161) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0090498 + k( 162) = ( 0.4937500 0.4937500 0.5125000), wk = 0.0090498 + k( 163) = ( 0.4875000 0.4875000 0.5250000), wk = 0.0090498 + k( 164) = ( 0.4812500 0.4812500 0.5375000), wk = 0.0090498 + k( 165) = ( 0.4750000 0.4750000 0.5500000), wk = 0.0090498 + k( 166) = ( 0.4687500 0.4687500 0.5625000), wk = 0.0090498 + k( 167) = ( 0.4625000 0.4625000 0.5750000), wk = 0.0090498 + k( 168) = ( 0.4562500 0.4562500 0.5875000), wk = 0.0090498 + k( 169) = ( 0.4500000 0.4500000 0.6000000), wk = 0.0090498 + k( 170) = ( 0.4437500 0.4437500 0.6125000), wk = 0.0090498 + k( 171) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0090498 + k( 172) = ( 0.4312500 0.4312500 0.6375000), wk = 0.0090498 + k( 173) = ( 0.4250000 0.4250000 0.6500000), wk = 0.0090498 + k( 174) = ( 0.4187500 0.4187500 0.6625000), wk = 0.0090498 + k( 175) = ( 0.4125000 0.4125000 0.6750000), wk = 0.0090498 + k( 176) = ( 0.4062500 0.4062500 0.6875000), wk = 0.0090498 + k( 177) = ( 0.4000000 0.4000000 0.7000000), wk = 0.0090498 + k( 178) = ( 0.3937500 0.3937500 0.7125000), wk = 0.0090498 + k( 179) = ( 0.3875000 0.3875000 0.7250000), wk = 0.0090498 + k( 180) = ( 0.3812500 0.3812500 0.7375000), wk = 0.0090498 + k( 181) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0090498 + k( 182) = ( 0.3875000 0.3687500 0.7437500), wk = 0.0090498 + k( 183) = ( 0.4000000 0.3625000 0.7375000), wk = 0.0090498 + k( 184) = ( 0.4125000 0.3562500 0.7312500), wk = 0.0090498 + k( 185) = ( 0.4250000 0.3500000 0.7250000), wk = 0.0090498 + k( 186) = ( 0.4375000 0.3437500 0.7187500), wk = 0.0090498 + k( 187) = ( 0.4500000 0.3375000 0.7125000), wk = 0.0090498 + k( 188) = ( 0.4625000 0.3312500 0.7062500), wk = 0.0090498 + k( 189) = ( 0.4750000 0.3250000 0.7000000), wk = 0.0090498 + k( 190) = ( 0.4875000 0.3187500 0.6937500), wk = 0.0090498 + k( 191) = ( 0.5000000 0.3125000 0.6875000), wk = 0.0090498 + k( 192) = ( 0.5125000 0.3062500 0.6812500), wk = 0.0090498 + k( 193) = ( 0.5250000 0.3000000 0.6750000), wk = 0.0090498 + k( 194) = ( 0.5375000 0.2937500 0.6687500), wk = 0.0090498 + k( 195) = ( 0.5500000 0.2875000 0.6625000), wk = 0.0090498 + k( 196) = ( 0.5625000 0.2812500 0.6562500), wk = 0.0090498 + k( 197) = ( 0.5750000 0.2750000 0.6500000), wk = 0.0090498 + k( 198) = ( 0.5875000 0.2687500 0.6437500), wk = 0.0090498 + k( 199) = ( 0.6000000 0.2625000 0.6375000), wk = 0.0090498 + k( 200) = ( 0.6125000 0.2562500 0.6312500), wk = 0.0090498 + k( 201) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0090498 + k( 202) = ( 0.6187500 0.2375000 0.6187500), wk = 0.0090498 + k( 203) = ( 0.6125000 0.2250000 0.6125000), wk = 0.0090498 + k( 204) = ( 0.6062500 0.2125000 0.6062500), wk = 0.0090498 + k( 205) = ( 0.6000000 0.2000000 0.6000000), wk = 0.0090498 + k( 206) = ( 0.5937500 0.1875000 0.5937500), wk = 0.0090498 + k( 207) = ( 0.5875000 0.1750000 0.5875000), wk = 0.0090498 + k( 208) = ( 0.5812500 0.1625000 0.5812500), wk = 0.0090498 + k( 209) = ( 0.5750000 0.1500000 0.5750000), wk = 0.0090498 + k( 210) = ( 0.5687500 0.1375000 0.5687500), wk = 0.0090498 + k( 211) = ( 0.5625000 0.1250000 0.5625000), wk = 0.0090498 + k( 212) = ( 0.5562500 0.1125000 0.5562500), wk = 0.0090498 + k( 213) = ( 0.5500000 0.1000000 0.5500000), wk = 0.0090498 + k( 214) = ( 0.5437500 0.0875000 0.5437500), wk = 0.0090498 + k( 215) = ( 0.5375000 0.0750000 0.5375000), wk = 0.0090498 + k( 216) = ( 0.5312500 0.0625000 0.5312500), wk = 0.0090498 + k( 217) = ( 0.5250000 0.0500000 0.5250000), wk = 0.0090498 + k( 218) = ( 0.5187500 0.0375000 0.5187500), wk = 0.0090498 + k( 219) = ( 0.5125000 0.0250000 0.5125000), wk = 0.0090498 + k( 220) = ( 0.5062500 0.0125000 0.5062500), wk = 0.0090498 + k( 221) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0090498 + + cryst. coord. + k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0090498 + k( 2) = ( 0.0250000 0.0000000 0.0250000), wk = 0.0090498 + k( 3) = ( 0.0500000 0.0000000 0.0500000), wk = 0.0090498 + k( 4) = ( 0.0750000 0.0000000 0.0750000), wk = 0.0090498 + k( 5) = ( 0.1000000 0.0000000 0.1000000), wk = 0.0090498 + k( 6) = ( 0.1250000 0.0000000 0.1250000), wk = 0.0090498 + k( 7) = ( 0.1500000 0.0000000 0.1500000), wk = 0.0090498 + k( 8) = ( 0.1750000 0.0000000 0.1750000), wk = 0.0090498 + k( 9) = ( 0.2000000 0.0000000 0.2000000), wk = 0.0090498 + k( 10) = ( 0.2250000 0.0000000 0.2250000), wk = 0.0090498 + k( 11) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0090498 + k( 12) = ( 0.2750000 0.0000000 0.2750000), wk = 0.0090498 + k( 13) = ( 0.3000000 0.0000000 0.3000000), wk = 0.0090498 + k( 14) = ( 0.3250000 0.0000000 0.3250000), wk = 0.0090498 + k( 15) = ( 0.3500000 0.0000000 0.3500000), wk = 0.0090498 + k( 16) = ( 0.3750000 0.0000000 0.3750000), wk = 0.0090498 + k( 17) = ( 0.4000000 0.0000000 0.4000000), wk = 0.0090498 + k( 18) = ( 0.4250000 0.0000000 0.4250000), wk = 0.0090498 + k( 19) = ( 0.4500000 0.0000000 0.4500000), wk = 0.0090498 + k( 20) = ( 0.4750000 0.0000000 0.4750000), wk = 0.0090498 + k( 21) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0090498 + k( 22) = ( 0.5000000 0.0125000 0.5125000), wk = 0.0090498 + k( 23) = ( 0.5000000 0.0250000 0.5250000), wk = 0.0090498 + k( 24) = ( 0.5000000 0.0375000 0.5375000), wk = 0.0090498 + k( 25) = ( 0.5000000 0.0500000 0.5500000), wk = 0.0090498 + k( 26) = ( 0.5000000 0.0625000 0.5625000), wk = 0.0090498 + k( 27) = ( 0.5000000 0.0750000 0.5750000), wk = 0.0090498 + k( 28) = ( 0.5000000 0.0875000 0.5875000), wk = 0.0090498 + k( 29) = ( 0.5000000 0.1000000 0.6000000), wk = 0.0090498 + k( 30) = ( 0.5000000 0.1125000 0.6125000), wk = 0.0090498 + k( 31) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0090498 + k( 32) = ( 0.5000000 0.1375000 0.6375000), wk = 0.0090498 + k( 33) = ( 0.5000000 0.1500000 0.6500000), wk = 0.0090498 + k( 34) = ( 0.5000000 0.1625000 0.6625000), wk = 0.0090498 + k( 35) = ( 0.5000000 0.1750000 0.6750000), wk = 0.0090498 + k( 36) = ( 0.5000000 0.1875000 0.6875000), wk = 0.0090498 + k( 37) = ( 0.5000000 0.2000000 0.7000000), wk = 0.0090498 + k( 38) = ( 0.5000000 0.2125000 0.7125000), wk = 0.0090498 + k( 39) = ( 0.5000000 0.2250000 0.7250000), wk = 0.0090498 + k( 40) = ( 0.5000000 0.2375000 0.7375000), wk = 0.0090498 + k( 41) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0090498 + k( 42) = ( 0.4937500 0.2562500 0.7500000), wk = 0.0090498 + k( 43) = ( 0.4875000 0.2625000 0.7500000), wk = 0.0090498 + k( 44) = ( 0.4812500 0.2687500 0.7500000), wk = 0.0090498 + k( 45) = ( 0.4750000 0.2750000 0.7500000), wk = 0.0090498 + k( 46) = ( 0.4687500 0.2812500 0.7500000), wk = 0.0090498 + k( 47) = ( 0.4625000 0.2875000 0.7500000), wk = 0.0090498 + k( 48) = ( 0.4562500 0.2937500 0.7500000), wk = 0.0090498 + k( 49) = ( 0.4500000 0.3000000 0.7500000), wk = 0.0090498 + k( 50) = ( 0.4437500 0.3062500 0.7500000), wk = 0.0090498 + k( 51) = ( 0.4375000 0.3125000 0.7500000), wk = 0.0090498 + k( 52) = ( 0.4312500 0.3187500 0.7500000), wk = 0.0090498 + k( 53) = ( 0.4250000 0.3250000 0.7500000), wk = 0.0090498 + k( 54) = ( 0.4187500 0.3312500 0.7500000), wk = 0.0090498 + k( 55) = ( 0.4125000 0.3375000 0.7500000), wk = 0.0090498 + k( 56) = ( 0.4062500 0.3437500 0.7500000), wk = 0.0090498 + k( 57) = ( 0.4000000 0.3500000 0.7500000), wk = 0.0090498 + k( 58) = ( 0.3937500 0.3562500 0.7500000), wk = 0.0090498 + k( 59) = ( 0.3875000 0.3625000 0.7500000), wk = 0.0090498 + k( 60) = ( 0.3812500 0.3687500 0.7500000), wk = 0.0090498 + k( 61) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0090498 + k( 62) = ( 0.3562500 0.3562500 0.7125000), wk = 0.0090498 + k( 63) = ( 0.3375000 0.3375000 0.6750000), wk = 0.0090498 + k( 64) = ( 0.3187500 0.3187500 0.6375000), wk = 0.0090498 + k( 65) = ( 0.3000000 0.3000000 0.6000000), wk = 0.0090498 + k( 66) = ( 0.2812500 0.2812500 0.5625000), wk = 0.0090498 + k( 67) = ( 0.2625000 0.2625000 0.5250000), wk = 0.0090498 + k( 68) = ( 0.2437500 0.2437500 0.4875000), wk = 0.0090498 + k( 69) = ( 0.2250000 0.2250000 0.4500000), wk = 0.0090498 + k( 70) = ( 0.2062500 0.2062500 0.4125000), wk = 0.0090498 + k( 71) = ( 0.1875000 0.1875000 0.3750000), wk = 0.0090498 + k( 72) = ( 0.1687500 0.1687500 0.3375000), wk = 0.0090498 + k( 73) = ( 0.1500000 0.1500000 0.3000000), wk = 0.0090498 + k( 74) = ( 0.1312500 0.1312500 0.2625000), wk = 0.0090498 + k( 75) = ( 0.1125000 0.1125000 0.2250000), wk = 0.0090498 + k( 76) = ( 0.0937500 0.0937500 0.1875000), wk = 0.0090498 + k( 77) = ( 0.0750000 0.0750000 0.1500000), wk = 0.0090498 + k( 78) = ( 0.0562500 0.0562500 0.1125000), wk = 0.0090498 + k( 79) = ( 0.0375000 0.0375000 0.0750000), wk = 0.0090498 + k( 80) = ( 0.0187500 0.0187500 0.0375000), wk = 0.0090498 + k( 81) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0090498 + k( 82) = ( 0.0250000 0.0250000 0.0250000), wk = 0.0090498 + k( 83) = ( 0.0500000 0.0500000 0.0500000), wk = 0.0090498 + k( 84) = ( 0.0750000 0.0750000 0.0750000), wk = 0.0090498 + k( 85) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0090498 + k( 86) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0090498 + k( 87) = ( 0.1500000 0.1500000 0.1500000), wk = 0.0090498 + k( 88) = ( 0.1750000 0.1750000 0.1750000), wk = 0.0090498 + k( 89) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0090498 + k( 90) = ( 0.2250000 0.2250000 0.2250000), wk = 0.0090498 + k( 91) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0090498 + k( 92) = ( 0.2750000 0.2750000 0.2750000), wk = 0.0090498 + k( 93) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0090498 + k( 94) = ( 0.3250000 0.3250000 0.3250000), wk = 0.0090498 + k( 95) = ( 0.3500000 0.3500000 0.3500000), wk = 0.0090498 + k( 96) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0090498 + k( 97) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0090498 + k( 98) = ( 0.4250000 0.4250000 0.4250000), wk = 0.0090498 + k( 99) = ( 0.4500000 0.4500000 0.4500000), wk = 0.0090498 + k( 100) = ( 0.4750000 0.4750000 0.4750000), wk = 0.0090498 + k( 101) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0090498 + k( 102) = ( 0.5062500 0.4875000 0.5062500), wk = 0.0090498 + k( 103) = ( 0.5125000 0.4750000 0.5125000), wk = 0.0090498 + k( 104) = ( 0.5187500 0.4625000 0.5187500), wk = 0.0090498 + k( 105) = ( 0.5250000 0.4500000 0.5250000), wk = 0.0090498 + k( 106) = ( 0.5312500 0.4375000 0.5312500), wk = 0.0090498 + k( 107) = ( 0.5375000 0.4250000 0.5375000), wk = 0.0090498 + k( 108) = ( 0.5437500 0.4125000 0.5437500), wk = 0.0090498 + k( 109) = ( 0.5500000 0.4000000 0.5500000), wk = 0.0090498 + k( 110) = ( 0.5562500 0.3875000 0.5562500), wk = 0.0090498 + k( 111) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0090498 + k( 112) = ( 0.5687500 0.3625000 0.5687500), wk = 0.0090498 + k( 113) = ( 0.5750000 0.3500000 0.5750000), wk = 0.0090498 + k( 114) = ( 0.5812500 0.3375000 0.5812500), wk = 0.0090498 + k( 115) = ( 0.5875000 0.3250000 0.5875000), wk = 0.0090498 + k( 116) = ( 0.5937500 0.3125000 0.5937500), wk = 0.0090498 + k( 117) = ( 0.6000000 0.3000000 0.6000000), wk = 0.0090498 + k( 118) = ( 0.6062500 0.2875000 0.6062500), wk = 0.0090498 + k( 119) = ( 0.6125000 0.2750000 0.6125000), wk = 0.0090498 + k( 120) = ( 0.6187500 0.2625000 0.6187500), wk = 0.0090498 + k( 121) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0090498 + k( 122) = ( 0.6187500 0.2500000 0.6312500), wk = 0.0090498 + k( 123) = ( 0.6125000 0.2500000 0.6375000), wk = 0.0090498 + k( 124) = ( 0.6062500 0.2500000 0.6437500), wk = 0.0090498 + k( 125) = ( 0.6000000 0.2500000 0.6500000), wk = 0.0090498 + k( 126) = ( 0.5937500 0.2500000 0.6562500), wk = 0.0090498 + k( 127) = ( 0.5875000 0.2500000 0.6625000), wk = 0.0090498 + k( 128) = ( 0.5812500 0.2500000 0.6687500), wk = 0.0090498 + k( 129) = ( 0.5750000 0.2500000 0.6750000), wk = 0.0090498 + k( 130) = ( 0.5687500 0.2500000 0.6812500), wk = 0.0090498 + k( 131) = ( 0.5625000 0.2500000 0.6875000), wk = 0.0090498 + k( 132) = ( 0.5562500 0.2500000 0.6937500), wk = 0.0090498 + k( 133) = ( 0.5500000 0.2500000 0.7000000), wk = 0.0090498 + k( 134) = ( 0.5437500 0.2500000 0.7062500), wk = 0.0090498 + k( 135) = ( 0.5375000 0.2500000 0.7125000), wk = 0.0090498 + k( 136) = ( 0.5312500 0.2500000 0.7187500), wk = 0.0090498 + k( 137) = ( 0.5250000 0.2500000 0.7250000), wk = 0.0090498 + k( 138) = ( 0.5187500 0.2500000 0.7312500), wk = 0.0090498 + k( 139) = ( 0.5125000 0.2500000 0.7375000), wk = 0.0090498 + k( 140) = ( 0.5062500 0.2500000 0.7437500), wk = 0.0090498 + k( 141) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0090498 + k( 142) = ( 0.5000000 0.2625000 0.7375000), wk = 0.0090498 + k( 143) = ( 0.5000000 0.2750000 0.7250000), wk = 0.0090498 + k( 144) = ( 0.5000000 0.2875000 0.7125000), wk = 0.0090498 + k( 145) = ( 0.5000000 0.3000000 0.7000000), wk = 0.0090498 + k( 146) = ( 0.5000000 0.3125000 0.6875000), wk = 0.0090498 + k( 147) = ( 0.5000000 0.3250000 0.6750000), wk = 0.0090498 + k( 148) = ( 0.5000000 0.3375000 0.6625000), wk = 0.0090498 + k( 149) = ( 0.5000000 0.3500000 0.6500000), wk = 0.0090498 + k( 150) = ( 0.5000000 0.3625000 0.6375000), wk = 0.0090498 + k( 151) = ( 0.5000000 0.3750000 0.6250000), wk = 0.0090498 + k( 152) = ( 0.5000000 0.3875000 0.6125000), wk = 0.0090498 + k( 153) = ( 0.5000000 0.4000000 0.6000000), wk = 0.0090498 + k( 154) = ( 0.5000000 0.4125000 0.5875000), wk = 0.0090498 + k( 155) = ( 0.5000000 0.4250000 0.5750000), wk = 0.0090498 + k( 156) = ( 0.5000000 0.4375000 0.5625000), wk = 0.0090498 + k( 157) = ( 0.5000000 0.4500000 0.5500000), wk = 0.0090498 + k( 158) = ( 0.5000000 0.4625000 0.5375000), wk = 0.0090498 + k( 159) = ( 0.5000000 0.4750000 0.5250000), wk = 0.0090498 + k( 160) = ( 0.5000000 0.4875000 0.5125000), wk = 0.0090498 + k( 161) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0090498 + k( 162) = ( 0.4937500 0.4937500 0.5125000), wk = 0.0090498 + k( 163) = ( 0.4875000 0.4875000 0.5250000), wk = 0.0090498 + k( 164) = ( 0.4812500 0.4812500 0.5375000), wk = 0.0090498 + k( 165) = ( 0.4750000 0.4750000 0.5500000), wk = 0.0090498 + k( 166) = ( 0.4687500 0.4687500 0.5625000), wk = 0.0090498 + k( 167) = ( 0.4625000 0.4625000 0.5750000), wk = 0.0090498 + k( 168) = ( 0.4562500 0.4562500 0.5875000), wk = 0.0090498 + k( 169) = ( 0.4500000 0.4500000 0.6000000), wk = 0.0090498 + k( 170) = ( 0.4437500 0.4437500 0.6125000), wk = 0.0090498 + k( 171) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0090498 + k( 172) = ( 0.4312500 0.4312500 0.6375000), wk = 0.0090498 + k( 173) = ( 0.4250000 0.4250000 0.6500000), wk = 0.0090498 + k( 174) = ( 0.4187500 0.4187500 0.6625000), wk = 0.0090498 + k( 175) = ( 0.4125000 0.4125000 0.6750000), wk = 0.0090498 + k( 176) = ( 0.4062500 0.4062500 0.6875000), wk = 0.0090498 + k( 177) = ( 0.4000000 0.4000000 0.7000000), wk = 0.0090498 + k( 178) = ( 0.3937500 0.3937500 0.7125000), wk = 0.0090498 + k( 179) = ( 0.3875000 0.3875000 0.7250000), wk = 0.0090498 + k( 180) = ( 0.3812500 0.3812500 0.7375000), wk = 0.0090498 + k( 181) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0090498 + k( 182) = ( 0.3875000 0.3687500 0.7437500), wk = 0.0090498 + k( 183) = ( 0.4000000 0.3625000 0.7375000), wk = 0.0090498 + k( 184) = ( 0.4125000 0.3562500 0.7312500), wk = 0.0090498 + k( 185) = ( 0.4250000 0.3500000 0.7250000), wk = 0.0090498 + k( 186) = ( 0.4375000 0.3437500 0.7187500), wk = 0.0090498 + k( 187) = ( 0.4500000 0.3375000 0.7125000), wk = 0.0090498 + k( 188) = ( 0.4625000 0.3312500 0.7062500), wk = 0.0090498 + k( 189) = ( 0.4750000 0.3250000 0.7000000), wk = 0.0090498 + k( 190) = ( 0.4875000 0.3187500 0.6937500), wk = 0.0090498 + k( 191) = ( 0.5000000 0.3125000 0.6875000), wk = 0.0090498 + k( 192) = ( 0.5125000 0.3062500 0.6812500), wk = 0.0090498 + k( 193) = ( 0.5250000 0.3000000 0.6750000), wk = 0.0090498 + k( 194) = ( 0.5375000 0.2937500 0.6687500), wk = 0.0090498 + k( 195) = ( 0.5500000 0.2875000 0.6625000), wk = 0.0090498 + k( 196) = ( 0.5625000 0.2812500 0.6562500), wk = 0.0090498 + k( 197) = ( 0.5750000 0.2750000 0.6500000), wk = 0.0090498 + k( 198) = ( 0.5875000 0.2687500 0.6437500), wk = 0.0090498 + k( 199) = ( 0.6000000 0.2625000 0.6375000), wk = 0.0090498 + k( 200) = ( 0.6125000 0.2562500 0.6312500), wk = 0.0090498 + k( 201) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0090498 + k( 202) = ( 0.6187500 0.2375000 0.6187500), wk = 0.0090498 + k( 203) = ( 0.6125000 0.2250000 0.6125000), wk = 0.0090498 + k( 204) = ( 0.6062500 0.2125000 0.6062500), wk = 0.0090498 + k( 205) = ( 0.6000000 0.2000000 0.6000000), wk = 0.0090498 + k( 206) = ( 0.5937500 0.1875000 0.5937500), wk = 0.0090498 + k( 207) = ( 0.5875000 0.1750000 0.5875000), wk = 0.0090498 + k( 208) = ( 0.5812500 0.1625000 0.5812500), wk = 0.0090498 + k( 209) = ( 0.5750000 0.1500000 0.5750000), wk = 0.0090498 + k( 210) = ( 0.5687500 0.1375000 0.5687500), wk = 0.0090498 + k( 211) = ( 0.5625000 0.1250000 0.5625000), wk = 0.0090498 + k( 212) = ( 0.5562500 0.1125000 0.5562500), wk = 0.0090498 + k( 213) = ( 0.5500000 0.1000000 0.5500000), wk = 0.0090498 + k( 214) = ( 0.5437500 0.0875000 0.5437500), wk = 0.0090498 + k( 215) = ( 0.5375000 0.0750000 0.5375000), wk = 0.0090498 + k( 216) = ( 0.5312500 0.0625000 0.5312500), wk = 0.0090498 + k( 217) = ( 0.5250000 0.0500000 0.5250000), wk = 0.0090498 + k( 218) = ( 0.5187500 0.0375000 0.5187500), wk = 0.0090498 + k( 219) = ( 0.5125000 0.0250000 0.5125000), wk = 0.0090498 + k( 220) = ( 0.5062500 0.0125000 0.5062500), wk = 0.0090498 + k( 221) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0090498 + + Dense grid: 13133 G-vectors FFT dimensions: ( 30, 30, 30) + + Dynamical RAM for wfc: 0.40 MB + + Dynamical RAM for wfc (w. buffer): 0.40 MB + + Dynamical RAM for str. fact: 0.20 MB + + Dynamical RAM for local pot: 0.00 MB + + Dynamical RAM for nlocal pot: 1.59 MB + + Dynamical RAM for qrad: 0.21 MB + + Dynamical RAM for rho,v,vnew: 1.22 MB + + Dynamical RAM for G-vectors: 0.85 MB + + Dynamical RAM for h,s,v(r/c): 0.05 MB + + Dynamical RAM for : 0.02 MB + + Dynamical RAM for psi: 0.80 MB + + Dynamical RAM for hpsi: 0.80 MB + + Dynamical RAM for spsi: 0.80 MB + + Dynamical RAM for wfcinit/wfcrot: 1.62 MB + + Dynamical RAM for addusdens: 2.71 MB + + Estimated static dynamical RAM per process > 5.90 MB + + Estimated max dynamical RAM per process > 8.61 MB + + Estimated total dynamical RAM > 34.42 MB + + Check: negative core charge= -0.000010 + + The potential is recalculated from file : + /home/ponet/.julia/environments/DFControlDEV/outputs/Si.save/charge-density + + Starting wfcs are 32 randomized atomic wfcs + Checking if some PAW data can be deallocated... + + Band Structure Calculation + Davidson diagonalization with overlap + + Computing kpt #: 1 of 56 on this pool + total cpu time spent up to now is 0.4 secs + + Computing kpt #: 2 of 56 on this pool + total cpu time spent up to now is 0.6 secs + + Computing kpt #: 3 of 56 on this pool + total cpu time spent up to now is 0.9 secs + + Computing kpt #: 4 of 56 on this pool + total cpu time spent up to now is 1.1 secs + + Computing kpt #: 5 of 56 on this pool + total cpu time spent up to now is 1.3 secs + + Computing kpt #: 6 of 56 on this pool + total cpu time spent up to now is 1.5 secs + + Computing kpt #: 7 of 56 on this pool + total cpu time spent up to now is 1.7 secs + + Computing kpt #: 8 of 56 on this pool + total cpu time spent up to now is 1.8 secs + + Computing kpt #: 9 of 56 on this pool + total cpu time spent up to now is 2.0 secs + + Computing kpt #: 10 of 56 on this pool + total cpu time spent up to now is 2.2 secs + + Computing kpt #: 11 of 56 on this pool + total cpu time spent up to now is 2.4 secs + + Computing kpt #: 12 of 56 on this pool + total cpu time spent up to now is 2.6 secs + + Computing kpt #: 13 of 56 on this pool + total cpu time spent up to now is 2.8 secs + + Computing kpt #: 14 of 56 on this pool + total cpu time spent up to now is 3.0 secs + + Computing kpt #: 15 of 56 on this pool + total cpu time spent up to now is 3.2 secs + + Computing kpt #: 16 of 56 on this pool + total cpu time spent up to now is 3.4 secs + + Computing kpt #: 17 of 56 on this pool + total cpu time spent up to now is 3.6 secs + + Computing kpt #: 18 of 56 on this pool + total cpu time spent up to now is 3.8 secs + + Computing kpt #: 19 of 56 on this pool + total cpu time spent up to now is 4.0 secs + + Computing kpt #: 20 of 56 on this pool + total cpu time spent up to now is 4.2 secs + + Computing kpt #: 21 of 56 on this pool + total cpu time spent up to now is 4.4 secs + + Computing kpt #: 22 of 56 on this pool + total cpu time spent up to now is 4.6 secs + + Computing kpt #: 23 of 56 on this pool + total cpu time spent up to now is 4.8 secs + + Computing kpt #: 24 of 56 on this pool + total cpu time spent up to now is 5.0 secs + + Computing kpt #: 25 of 56 on this pool + total cpu time spent up to now is 5.2 secs + + Computing kpt #: 26 of 56 on this pool + total cpu time spent up to now is 5.4 secs + + Computing kpt #: 27 of 56 on this pool + total cpu time spent up to now is 5.6 secs + + Computing kpt #: 28 of 56 on this pool + total cpu time spent up to now is 5.8 secs + + Computing kpt #: 29 of 56 on this pool + total cpu time spent up to now is 6.0 secs + + Computing kpt #: 30 of 56 on this pool + total cpu time spent up to now is 6.2 secs + + Computing kpt #: 31 of 56 on this pool + total cpu time spent up to now is 6.4 secs + + Computing kpt #: 32 of 56 on this pool + total cpu time spent up to now is 6.6 secs + + Computing kpt #: 33 of 56 on this pool + total cpu time spent up to now is 6.7 secs + + Computing kpt #: 34 of 56 on this pool + total cpu time spent up to now is 6.9 secs + + Computing kpt #: 35 of 56 on this pool + total cpu time spent up to now is 7.1 secs + + Computing kpt #: 36 of 56 on this pool + total cpu time spent up to now is 7.3 secs + + Computing kpt #: 37 of 56 on this pool + total cpu time spent up to now is 7.5 secs + + Computing kpt #: 38 of 56 on this pool + total cpu time spent up to now is 7.7 secs + + Computing kpt #: 39 of 56 on this pool + total cpu time spent up to now is 7.9 secs + + Computing kpt #: 40 of 56 on this pool + total cpu time spent up to now is 8.0 secs + + Computing kpt #: 41 of 56 on this pool + total cpu time spent up to now is 8.2 secs + + Computing kpt #: 42 of 56 on this pool + total cpu time spent up to now is 8.4 secs + + Computing kpt #: 43 of 56 on this pool + total cpu time spent up to now is 8.6 secs + + Computing kpt #: 44 of 56 on this pool + total cpu time spent up to now is 8.8 secs + + Computing kpt #: 45 of 56 on this pool + total cpu time spent up to now is 9.0 secs + + Computing kpt #: 46 of 56 on this pool + total cpu time spent up to now is 9.1 secs + + Computing kpt #: 47 of 56 on this pool + total cpu time spent up to now is 9.3 secs + + Computing kpt #: 48 of 56 on this pool + total cpu time spent up to now is 9.5 secs + + Computing kpt #: 49 of 56 on this pool + total cpu time spent up to now is 9.7 secs + + Computing kpt #: 50 of 56 on this pool + total cpu time spent up to now is 9.9 secs + + Computing kpt #: 51 of 56 on this pool + total cpu time spent up to now is 10.0 secs + + Computing kpt #: 52 of 56 on this pool + total cpu time spent up to now is 10.2 secs + + Computing kpt #: 53 of 56 on this pool + total cpu time spent up to now is 10.4 secs + + Computing kpt #: 54 of 56 on this pool + total cpu time spent up to now is 10.6 secs + + Computing kpt #: 55 of 56 on this pool + total cpu time spent up to now is 10.8 secs + + Computing kpt #: 56 of 56 on this pool + total cpu time spent up to now is 11.0 secs + + ethr = 3.12E-09, avg # of iterations = 26.4 + + total cpu time spent up to now is 11.0 secs + + End of band structure calculation + + k = 0.0000 0.0000 0.0000 ( 1647 PWs) bands (ev): + + -5.8294 -1.6690 -1.6690 -1.6690 -1.6689 -1.6689 -1.6668 3.2886 + 3.2886 3.2886 3.2893 3.2893 3.2893 6.1733 6.1733 6.1733 + + k = 0.0250 0.0000 0.0250 ( 1641 PWs) bands (ev): + + -5.8239 -1.8604 -1.8597 -1.6707 -1.6626 -1.4722 -1.4715 3.2502 + 3.2821 3.2825 3.2830 3.2834 3.2934 6.1137 6.1488 6.1709 + + k = 0.0500 0.0000 0.0500 ( 1641 PWs) bands (ev): + + -5.8075 -2.0456 -2.0449 -1.6774 -1.6449 -1.2714 -1.2708 3.1413 + 3.2614 3.2617 3.2676 3.2681 3.3067 5.9492 6.0770 6.1637 + + k = 0.0750 0.0000 0.0750 ( 1645 PWs) bands (ev): + + -5.7800 -2.2237 -2.2230 -1.6894 -1.6153 -1.0688 -1.0682 2.9815 + 3.2264 3.2266 3.2469 3.2474 3.3287 5.7103 5.9629 6.1513 + + k = 0.1000 0.0000 0.1000 ( 1637 PWs) bands (ev): + + -5.7417 -2.3941 -2.3933 -1.7079 -1.5737 -0.8660 -0.8654 2.7921 + 3.1785 3.1787 3.2256 3.2262 3.3597 5.4254 5.8131 6.1335 + + k = 0.1250 0.0000 0.1250 ( 1643 PWs) bands (ev): + + -5.6924 -2.5561 -2.5553 -1.7350 -1.5205 -0.6655 -0.6649 2.5912 + 3.1199 3.1200 3.2089 3.2095 3.3992 5.1141 5.6349 6.1097 + + k = 0.1500 0.0000 0.1500 ( 1643 PWs) bands (ev): + + -5.6325 -2.7091 -2.7084 -1.7729 -1.4555 -0.4701 -0.4696 2.3930 + 3.0533 3.0533 3.2021 3.2027 3.4471 4.7886 5.4331 6.0792 + + k = 0.1750 0.0000 0.1750 ( 1642 PWs) bands (ev): + + -5.5618 -2.8528 -2.8521 -1.8237 -1.3788 -0.2832 -0.2827 2.2080 + 2.9815 2.9815 3.2104 3.2111 3.5034 4.4566 5.2159 6.0412 + + k = 0.2000 0.0000 0.2000 ( 1630 PWs) bands (ev): + + -5.4805 -2.9869 -2.9862 -1.8901 -1.2903 -0.1083 -0.1079 2.0443 + 2.9072 2.9072 3.2387 3.2394 3.5679 4.1250 4.9876 5.9958 + + k = 0.2250 0.0000 0.2250 ( 1632 PWs) bands (ev): + + -5.3888 -3.1111 -3.1103 -1.9738 -1.1901 0.0508 0.0512 1.9079 + 2.8326 2.8326 3.2913 3.2921 3.6403 3.7951 4.7519 5.9417 + + k = 0.2500 0.0000 0.2500 ( 1628 PWs) bands (ev): + + -5.2869 -3.2251 -3.2244 -2.0764 -1.0783 0.1914 0.1917 1.8024 + 2.7598 2.7598 3.3716 3.3724 3.4687 3.7202 4.5121 5.8785 + + k = 0.2750 0.0000 0.2750 ( 1622 PWs) bands (ev): + + -5.1749 -3.3288 -3.3280 -2.1975 -0.9548 0.3111 0.3115 1.7302 + 2.6902 2.6902 3.1494 3.4811 3.4819 3.8075 4.2712 5.8063 + + k = 0.3000 0.0000 0.3000 ( 1620 PWs) bands (ev): + + -5.0531 -3.4219 -3.4212 -2.3363 -0.8198 0.4096 0.4099 1.6916 + 2.6252 2.6253 2.8371 3.6190 3.6200 3.9015 4.0313 5.7254 + + k = 0.3250 0.0000 0.3250 ( 1614 PWs) bands (ev): + + -4.9218 -3.5044 -3.5036 -2.4908 -0.6733 0.4877 0.4879 1.6856 + 2.5332 2.5659 2.5660 3.7824 3.7834 3.7950 4.0019 5.6353 + + k = 0.3500 0.0000 0.3500 ( 1618 PWs) bands (ev): + + -4.7813 -3.5761 -3.5753 -2.6582 -0.5153 0.5473 0.5476 1.7102 + 2.2377 2.5130 2.5131 3.5635 3.9655 3.9665 4.1082 5.5370 + + k = 0.3750 0.0000 0.3750 ( 1632 PWs) bands (ev): + + -4.6320 -3.6369 -3.6362 -2.8356 -0.3459 0.5915 0.5917 1.7629 + 1.9507 2.4673 2.4675 3.3385 4.1603 4.1613 4.2198 5.4305 + + k = 0.4000 0.0000 0.4000 ( 1636 PWs) bands (ev): + + -4.4745 -3.6868 -3.6860 -3.0200 -0.1654 0.6230 0.6232 1.6740 + 1.8411 2.4294 2.4296 3.1217 4.3359 4.3561 4.3571 5.3184 + + k = 0.4250 0.0000 0.4250 ( 1636 PWs) bands (ev): + + -4.3092 -3.7257 -3.7249 -3.2084 0.0266 0.6446 0.6448 1.4072 + 1.9422 2.3994 2.3996 2.9141 4.4559 4.5387 4.5397 5.2010 + + k = 0.4500 0.0000 0.4500 ( 1634 PWs) bands (ev): + + -4.1370 -3.7534 -3.7527 -3.3985 0.2296 0.6583 0.6585 1.1505 + 2.0639 2.3780 2.3782 2.7172 4.5788 4.6905 4.6916 5.0797 + + k = 0.4750 0.0000 0.4750 ( 1638 PWs) bands (ev): + + -3.9587 -3.7701 -3.7693 -3.5881 0.4436 0.6660 0.6662 0.9042 + 2.2040 2.3650 2.3652 2.5323 4.7036 4.7928 4.7939 4.9556 + + k = 0.5000 0.0000 0.5000 ( 1628 PWs) bands (ev): + + -3.7759 -3.7757 -3.7757 -3.7739 0.6684 0.6684 0.6685 0.6687 + 2.3603 2.3608 2.3608 2.3611 4.8292 4.8297 4.8305 4.8305 + + k = 0.5000 0.0125 0.5125 ( 1632 PWs) bands (ev): + + -3.8213 -3.8203 -3.7286 -3.7276 0.6066 0.6068 0.7216 0.7218 + 2.3257 2.3261 2.4080 2.4084 4.7961 4.7964 4.8592 4.8594 + + k = 0.5000 0.0250 0.5250 ( 1638 PWs) bands (ev): + + -3.8651 -3.8640 -3.6799 -3.6788 0.5369 0.5371 0.7658 0.7660 + 2.3028 2.3032 2.4680 2.4684 4.7583 4.7586 4.8840 4.8842 + + k = 0.5000 0.0375 0.5375 ( 1638 PWs) bands (ev): + + -3.9068 -3.9058 -3.6297 -3.6287 0.4603 0.4606 0.8013 0.8015 + 2.2909 2.2914 2.5403 2.5407 4.7168 4.7171 4.9045 4.9048 + + k = 0.5000 0.0500 0.5500 ( 1638 PWs) bands (ev): + + -3.9466 -3.9456 -3.5784 -3.5774 0.3783 0.3786 0.8286 0.8289 + 2.2890 2.2895 2.6238 2.6243 4.6717 4.6720 4.9207 4.9209 + + k = 0.5000 0.0625 0.5625 ( 1638 PWs) bands (ev): + + -3.9843 -3.9833 -3.5261 -3.5251 0.2922 0.2926 0.8487 0.8490 + 2.2958 2.2963 2.7175 2.7180 4.6234 4.6237 4.9323 4.9325 + + k = 0.5000 0.0750 0.5750 ( 1638 PWs) bands (ev): + + -4.0198 -4.0188 -3.4732 -3.4721 0.2035 0.2039 0.8626 0.8630 + 2.3099 2.3104 2.8199 2.8204 4.5725 4.5728 4.9393 4.9395 + + k = 0.5000 0.0875 0.5875 ( 1640 PWs) bands (ev): + + -4.0531 -4.0521 -3.4198 -3.4188 0.1135 0.1139 0.8714 0.8718 + 2.3302 2.3308 2.9296 2.9301 4.5193 4.5196 4.9419 4.9421 + + k = 0.5000 0.1000 0.6000 ( 1636 PWs) bands (ev): + + -4.0841 -4.0831 -3.3664 -3.3654 0.0235 0.0239 0.8762 0.8767 + 2.3556 2.3562 3.0450 3.0455 4.4645 4.4647 4.9400 4.9402 + + k = 0.5000 0.1125 0.6125 ( 1634 PWs) bands (ev): + + -4.1128 -4.1118 -3.3133 -3.3123 -0.0654 -0.0649 0.8779 0.8784 + 2.3851 2.3858 3.1647 3.1653 4.4086 4.4088 4.9333 4.9336 + + k = 0.5000 0.1250 0.6250 ( 1632 PWs) bands (ev): + + -4.1391 -4.1380 -3.2612 -3.2602 -0.1520 -0.1516 0.8774 0.8779 + 2.4175 2.4182 3.2875 3.2881 4.3523 4.3526 4.9220 4.9222 + + k = 0.5000 0.1375 0.6375 ( 1632 PWs) bands (ev): + + -4.1630 -4.1619 -3.2104 -3.2094 -0.2351 -0.2347 0.8752 0.8758 + 2.4519 2.4527 3.4118 3.4124 4.2966 4.2968 4.9056 4.9059 + + k = 0.5000 0.1500 0.6500 ( 1628 PWs) bands (ev): + + -4.1844 -4.1834 -3.1617 -3.1607 -0.3138 -0.3135 0.8721 0.8727 + 2.4875 2.4882 3.5367 3.5372 4.2420 4.2422 4.8840 4.8843 + + k = 0.5000 0.1625 0.6625 ( 1630 PWs) bands (ev): + + -4.2034 -4.2024 -3.1157 -3.1147 -0.3869 -0.3866 0.8684 0.8690 + 2.5230 2.5237 3.6603 3.6608 4.1897 4.1899 4.8568 4.8572 + + k = 0.5000 0.1750 0.6750 ( 1634 PWs) bands (ev): + + -4.2199 -4.2189 -3.0733 -3.0723 -0.4534 -0.4531 0.8645 0.8651 + 2.5573 2.5581 3.7817 3.7822 4.1407 4.1408 4.8239 4.8243 + + k = 0.5000 0.1875 0.6875 ( 1632 PWs) bands (ev): + + -4.2339 -4.2329 -3.0353 -3.0344 -0.5121 -0.5118 0.8608 0.8614 + 2.5894 2.5902 3.8993 3.8998 4.0961 4.0963 4.7849 4.7853 + + k = 0.5000 0.2000 0.7000 ( 1632 PWs) bands (ev): + + -4.2454 -4.2444 -3.0026 -3.0016 -0.5619 -0.5617 0.8575 0.8581 + 2.6181 2.6190 4.0113 4.0116 4.0573 4.0574 4.7398 4.7404 + + k = 0.5000 0.2125 0.7125 ( 1638 PWs) bands (ev): + + -4.2543 -4.2533 -2.9760 -2.9751 -0.6019 -0.6018 0.8547 0.8553 + 2.6420 2.6429 4.0252 4.0253 4.1155 4.1158 4.6895 4.6901 + + k = 0.5000 0.2250 0.7250 ( 1644 PWs) bands (ev): + + -4.2607 -4.2597 -2.9564 -2.9554 -0.6313 -0.6311 0.8526 0.8532 + 2.6602 2.6611 4.0013 4.0013 4.2083 4.2085 4.6363 4.6371 + + k = 0.5000 0.2375 0.7375 ( 1644 PWs) bands (ev): + + -4.2646 -4.2635 -2.9443 -2.9434 -0.6491 -0.6491 0.8513 0.8519 + 2.6715 2.6724 3.9865 3.9865 4.2807 4.2808 4.5880 4.5890 + + k = 0.5000 0.2500 0.7500 ( 1622 PWs) bands (ev): + + -4.2658 -4.2648 -2.9403 -2.9393 -0.6551 -0.6551 0.8511 0.8517 + 2.6754 2.6763 3.9815 3.9815 4.3116 4.3119 4.5659 4.5670 + + k = 0.4938 0.2563 0.7500 ( 1649 PWs) bands (ev): + + -4.2785 -4.2292 -2.9542 -2.9526 -0.6569 -0.6555 0.7889 0.8487 + 2.7031 2.7047 4.0034 4.0042 4.2730 4.3621 4.5547 4.5943 + + k = 0.4875 0.2625 0.7500 ( 1649 PWs) bands (ev): + + -4.2911 -4.1926 -2.9701 -2.9650 -0.6588 -0.6533 0.7275 0.8461 + 2.7288 2.7344 4.0253 4.0282 4.2319 4.4071 4.5458 4.6268 + + k = 0.4813 0.2688 0.7500 ( 1649 PWs) bands (ev): + + -4.3029 -4.1557 -2.9880 -2.9766 -0.6607 -0.6485 0.6669 0.8435 + 2.7526 2.7651 4.0471 4.0533 4.1887 4.4452 4.5384 4.6645 + + k = 0.4750 0.2750 0.7500 ( 1646 PWs) bands (ev): + + -4.3141 -4.1186 -3.0078 -2.9876 -0.6626 -0.6410 0.6071 0.8409 + 2.7749 2.7968 4.0687 4.0796 4.1441 4.4764 4.5318 4.7074 + + k = 0.4688 0.2813 0.7500 ( 1644 PWs) bands (ev): + + -4.3247 -4.0811 -3.0293 -2.9980 -0.6646 -0.6310 0.5481 0.8384 + 2.7951 2.8294 4.0903 4.0985 4.1067 4.5015 4.5255 4.7545 + + k = 0.4625 0.2875 0.7500 ( 1644 PWs) bands (ev): + + -4.3345 -4.0433 -3.0525 -3.0077 -0.6666 -0.6184 0.4900 0.8358 + 2.8135 2.8629 4.0523 4.1117 4.1342 4.5191 4.5216 4.8042 + + k = 0.4563 0.2938 0.7500 ( 1643 PWs) bands (ev): + + -4.3437 -4.0053 -3.0773 -3.0167 -0.6685 -0.6034 0.4328 0.8334 + 2.8303 2.8973 4.0057 4.1328 4.1619 4.5127 4.5381 4.8551 + + k = 0.4500 0.3000 0.7500 ( 1645 PWs) bands (ev): + + -4.3522 -3.9671 -3.1037 -3.0250 -0.6704 -0.5859 0.3765 0.8310 + 2.8454 2.9325 3.9590 4.1537 4.1895 4.5058 4.5518 4.9059 + + k = 0.4438 0.3063 0.7500 ( 1641 PWs) bands (ev): + + -4.3600 -3.9287 -3.1314 -3.0328 -0.6722 -0.5660 0.3213 0.8287 + 2.8589 2.9686 3.9121 4.1744 4.2168 4.4985 4.5634 4.9557 + + k = 0.4375 0.3125 0.7500 ( 1641 PWs) bands (ev): + + -4.3671 -3.8901 -3.1605 -3.0398 -0.6739 -0.5439 0.2669 0.8266 + 2.8709 3.0054 3.8653 4.1947 4.2432 4.4906 4.5732 5.0038 + + k = 0.4313 0.3188 0.7500 ( 1638 PWs) bands (ev): + + -4.3736 -3.8514 -3.1909 -3.0462 -0.6755 -0.5195 0.2136 0.8247 + 2.8815 3.0429 3.8185 4.2147 4.2686 4.4820 4.5817 5.0495 + + k = 0.4250 0.3250 0.7500 ( 1638 PWs) bands (ev): + + -4.3794 -3.8126 -3.2224 -3.0519 -0.6770 -0.4930 0.1614 0.8229 + 2.8906 3.0812 3.7720 4.2343 4.2924 4.4728 4.5889 5.0922 + + k = 0.4188 0.3313 0.7500 ( 1637 PWs) bands (ev): + + -4.3845 -3.7738 -3.2550 -3.0569 -0.6783 -0.4645 0.1102 0.8213 + 2.8986 3.1201 3.7256 4.2534 4.3146 4.4629 4.5951 5.1314 + + k = 0.4125 0.3375 0.7500 ( 1639 PWs) bands (ev): + + -4.3889 -3.7350 -3.2885 -3.0613 -0.6794 -0.4340 0.0602 0.8198 + 2.9053 3.1598 3.6795 4.2722 4.3345 4.4523 4.6002 5.1665 + + k = 0.4063 0.3438 0.7500 ( 1639 PWs) bands (ev): + + -4.3927 -3.6962 -3.3229 -3.0650 -0.6805 -0.4016 0.0114 0.8186 + 2.9109 3.2001 3.6337 4.2905 4.3519 4.4410 4.6045 5.1972 + + k = 0.4000 0.3500 0.7500 ( 1639 PWs) bands (ev): + + -4.3957 -3.6575 -3.3580 -3.0680 -0.6813 -0.3674 -0.0363 0.8176 + 2.9154 3.2411 3.5881 4.3082 4.3669 4.4287 4.6079 5.2230 + + k = 0.3938 0.3563 0.7500 ( 1637 PWs) bands (ev): + + -4.3981 -3.6190 -3.3938 -3.0703 -0.6819 -0.3314 -0.0827 0.8168 + 2.9189 3.2826 3.5431 4.3254 4.3786 4.4160 4.6107 5.2435 + + k = 0.3875 0.3625 0.7500 ( 1635 PWs) bands (ev): + + -4.3998 -3.5806 -3.4303 -3.0720 -0.6824 -0.2937 -0.1277 0.8163 + 2.9213 3.3247 3.4984 4.3422 4.3871 4.4026 4.6126 5.2583 + + k = 0.3813 0.3688 0.7500 ( 1635 PWs) bands (ev): + + -4.4009 -3.5425 -3.4672 -3.0730 -0.6827 -0.2545 -0.1714 0.8159 + 2.9228 3.3674 3.4543 4.3582 4.3884 4.3922 4.6137 5.2673 + + k = 0.3750 0.3750 0.7500 ( 1638 PWs) bands (ev): + + -4.4012 -3.5051 -3.5042 -3.0734 -0.6828 -0.2137 -0.2137 0.8158 + 2.9232 3.4104 3.4107 4.3732 4.3741 4.3939 4.6140 5.2702 + + k = 0.3563 0.3563 0.7125 ( 1634 PWs) bands (ev): + + -4.4322 -3.4264 -3.4256 -3.1465 -0.6479 -0.3451 -0.3450 0.8026 + 3.1124 3.4375 3.4380 4.3659 4.3665 4.3766 4.9340 5.2427 + + k = 0.3375 0.3375 0.6750 ( 1632 PWs) bands (ev): + + -4.4452 -3.3422 -3.3413 -3.2848 -0.5175 -0.4559 -0.4558 0.7969 + 3.3118 3.3785 3.3792 4.3742 4.3757 4.3761 5.1375 5.1798 + + k = 0.3188 0.3188 0.6375 ( 1634 PWs) bands (ev): + + -4.4402 -3.4684 -3.2546 -3.2537 -0.5435 -0.5435 -0.3103 0.7991 + 3.2647 3.2655 3.5190 4.3598 4.3601 4.3871 5.0839 5.1757 + + k = 0.3000 0.3000 0.6000 ( 1633 PWs) bands (ev): + + -4.4169 -3.6776 -3.1660 -3.1651 -0.6065 -0.6064 -0.0453 0.8084 + 3.1204 3.1212 3.7321 4.2976 4.2977 4.4152 4.9625 5.0517 + + k = 0.2813 0.2813 0.5625 ( 1635 PWs) bands (ev): + + -4.3753 -3.8980 -3.0786 -3.0776 -0.6442 -0.6441 0.2635 0.8232 + 2.9590 2.9599 3.9483 4.1950 4.1951 4.4589 4.8163 4.8226 + + k = 0.2625 0.2625 0.5250 ( 1644 PWs) bands (ev): + + -4.3154 -4.1198 -2.9942 -2.9933 -0.6579 -0.6578 0.6066 0.8405 + 2.7891 2.7900 4.0694 4.0694 4.1660 4.5180 4.5220 4.6709 + + k = 0.2438 0.2438 0.4875 ( 1642 PWs) bands (ev): + + -4.3368 -4.2372 -2.9140 -2.9131 -0.6508 -0.6508 0.8556 0.9777 + 2.6194 2.6202 3.9378 3.9379 4.2048 4.3840 4.5133 4.5928 + + k = 0.2250 0.2250 0.4500 ( 1636 PWs) bands (ev): + + -4.5450 -4.1409 -2.8379 -2.8370 -0.6295 -0.6295 0.8613 1.3720 + 2.4592 2.4600 3.8125 3.8126 3.8904 4.3558 4.5989 4.6822 + + k = 0.2063 0.2063 0.4125 ( 1630 PWs) bands (ev): + + -4.7414 -4.0264 -2.7652 -2.7643 -0.6034 -0.6033 0.8474 1.7865 + 2.3209 2.3216 3.5984 3.7001 3.7002 4.2019 4.7860 4.8097 + + k = 0.1875 0.1875 0.3750 ( 1633 PWs) bands (ev): + + -4.9244 -3.8941 -2.6939 -2.6930 -0.5849 -0.5848 0.8010 2.2178 + 2.2185 2.2193 3.3484 3.6034 3.6036 4.0546 4.9036 5.0139 + + k = 0.1688 0.1688 0.3375 ( 1636 PWs) bands (ev): + + -5.0924 -3.7440 -2.6220 -2.6211 -0.5870 -0.5867 0.7084 2.1659 + 2.1665 2.6642 3.1568 3.5228 3.5230 3.9169 5.0339 5.2096 + + k = 0.1500 0.1500 0.3000 ( 1643 PWs) bands (ev): + + -5.2445 -3.5765 -2.5472 -2.5463 -0.6200 -0.6196 0.5607 2.1730 + 2.1734 3.0337 3.1225 3.4575 3.4577 3.7900 5.1757 5.3940 + + k = 0.1313 0.1313 0.2625 ( 1640 PWs) bands (ev): + + -5.3799 -3.3919 -2.4673 -2.4665 -0.6882 -0.6877 0.3588 2.2423 + 2.2427 2.9787 3.4061 3.4064 3.5894 3.6758 5.3273 5.5644 + + k = 0.1125 0.1125 0.2250 ( 1638 PWs) bands (ev): + + -5.4982 -3.1906 -2.3806 -2.3798 -0.7889 -0.7884 0.1126 2.3679 + 2.3682 2.9804 3.3669 3.3672 3.5751 4.0607 5.4853 5.7188 + + k = 0.0938 0.0938 0.1875 ( 1642 PWs) bands (ev): + + -5.5988 -2.9731 -2.2857 -2.2849 -0.9151 -0.9145 -0.1645 2.5371 + 2.5374 3.0224 3.3379 3.3382 3.4888 4.5309 5.6458 5.8537 + + k = 0.0750 0.0750 0.1500 ( 1642 PWs) bands (ev): + + -5.6815 -2.7399 -2.1815 -2.1808 -1.0582 -1.0576 -0.4599 2.7328 + 2.7331 3.0881 3.3173 3.3177 3.4174 4.9901 5.8017 5.9668 + + k = 0.0563 0.0563 0.1125 ( 1649 PWs) bands (ev): + + -5.7461 -2.4918 -2.0677 -2.0669 -1.2106 -1.2100 -0.7640 2.9337 + 2.9340 3.1610 3.3035 3.3038 3.3614 5.4222 5.9452 6.0565 + + k = 0.0375 0.0375 0.0750 ( 1647 PWs) bands (ev): + + -5.7924 -2.2298 -1.9439 -1.9432 -1.3659 -1.3652 -1.0700 3.1137 + 3.1141 3.2268 3.2949 3.2952 3.3212 5.7985 6.0643 6.1212 + + k = 0.0188 0.0188 0.0375 ( 1632 PWs) bands (ev): + + -5.8201 -1.9549 -1.8107 -1.8100 -1.5198 -1.5191 -1.3725 3.2420 + 3.2423 3.2726 3.2903 3.2906 3.2971 6.0707 6.1447 6.1602 + + k = 0.0000 0.0000 0.0000 ( 1647 PWs) bands (ev): + + -5.8294 -1.6690 -1.6690 -1.6690 -1.6689 -1.6689 -1.6668 3.2886 + 3.2886 3.2886 3.2893 3.2893 3.2893 6.1733 6.1733 6.1733 + + k = 0.0250 0.0250 0.0250 ( 1629 PWs) bands (ev): + + -5.8212 -1.8593 -1.8593 -1.8582 -1.4713 -1.4713 -1.4702 3.2525 + 3.2525 3.2531 3.2955 3.2961 3.2961 6.0741 6.1587 6.1587 + + k = 0.0500 0.0500 0.0500 ( 1644 PWs) bands (ev): + + -5.7965 -2.0410 -2.0410 -2.0399 -1.2691 -1.2691 -1.2682 3.1520 + 3.1520 3.1525 3.3162 3.3168 3.3168 5.8092 6.1168 6.1168 + + k = 0.0750 0.0750 0.0750 ( 1644 PWs) bands (ev): + + -5.7554 -2.2129 -2.2129 -2.2118 -1.0658 -1.0658 -1.0649 3.0080 + 3.0080 3.0085 3.3506 3.3511 3.3511 5.4397 6.0523 6.0523 + + k = 0.1000 0.1000 0.1000 ( 1650 PWs) bands (ev): + + -5.6980 -2.3740 -2.3740 -2.3729 -0.8663 -0.8663 -0.8654 2.8450 + 2.8450 2.8454 3.3984 3.3989 3.3989 5.0125 5.9712 5.9712 + + k = 0.1250 0.1250 0.1250 ( 1653 PWs) bands (ev): + + -5.6245 -2.5238 -2.5238 -2.5227 -0.6773 -0.6773 -0.6765 2.6857 + 2.6857 2.6862 3.4594 3.4599 3.4599 4.5539 5.8793 5.8793 + + k = 0.1500 0.1500 0.1500 ( 1638 PWs) bands (ev): + + -5.5351 -2.6620 -2.6620 -2.6608 -0.5083 -0.5083 -0.5076 2.5510 + 2.5510 2.5515 3.5332 3.5337 3.5337 4.0832 5.7821 5.7821 + + k = 0.1750 0.1750 0.1750 ( 1638 PWs) bands (ev): + + -5.4301 -2.7883 -2.7883 -2.7872 -0.3709 -0.3709 -0.3703 2.4602 + 2.4602 2.4608 3.6082 3.6191 3.6197 3.6197 5.6823 5.6823 + + k = 0.2000 0.2000 0.2000 ( 1638 PWs) bands (ev): + + -5.3099 -2.9029 -2.9029 -2.9017 -0.2769 -0.2769 -0.2763 2.4303 + 2.4303 2.4310 3.1353 3.7165 3.7171 3.7171 5.5849 5.5849 + + k = 0.2250 0.2250 0.2250 ( 1631 PWs) bands (ev): + + -5.1750 -3.0057 -3.0057 -3.0045 -0.2334 -0.2334 -0.2331 2.4720 + 2.4720 2.4727 2.6688 3.8245 3.8250 3.8250 5.4914 5.4914 + + k = 0.2500 0.2500 0.2500 ( 1637 PWs) bands (ev): + + -5.0262 -3.0971 -3.0971 -3.0958 -0.2397 -0.2397 -0.2395 2.2120 + 2.5861 2.5861 2.5870 3.9416 3.9422 3.9422 5.4033 5.4033 + + k = 0.2750 0.2750 0.2750 ( 1631 PWs) bands (ev): + + -4.8645 -3.1772 -3.1772 -3.1759 -0.2862 -0.2862 -0.2861 1.7675 + 2.7647 2.7647 2.7656 4.0665 4.0671 4.0671 5.3218 5.3218 + + k = 0.3000 0.3000 0.3000 ( 1622 PWs) bands (ev): + + -4.6912 -3.2465 -3.2465 -3.2451 -0.3595 -0.3595 -0.3595 1.3389 + 2.9944 2.9944 2.9954 4.1973 4.1979 4.1979 5.2477 5.2477 + + k = 0.3250 0.3250 0.3250 ( 1628 PWs) bands (ev): + + -4.5083 -3.3055 -3.3055 -3.3041 -0.4470 -0.4470 -0.4470 0.9287 + 3.2616 3.2616 3.2627 4.3308 4.3314 4.3314 5.1816 5.1816 + + k = 0.3500 0.3500 0.3500 ( 1628 PWs) bands (ev): + + -4.3186 -3.3547 -3.3547 -3.3534 -0.5382 -0.5381 -0.5381 0.5408 + 3.5546 3.5546 3.5557 4.4639 4.4645 4.4645 5.1236 5.1236 + + k = 0.3750 0.3750 0.3750 ( 1622 PWs) bands (ev): + + -4.1264 -3.3949 -3.3949 -3.3935 -0.6253 -0.6251 -0.6251 0.1799 + 3.8612 3.8612 3.8623 4.5924 4.5930 4.5930 5.0745 5.0745 + + k = 0.4000 0.4000 0.4000 ( 1634 PWs) bands (ev): + + -3.9380 -3.4266 -3.4266 -3.4252 -0.7028 -0.7026 -0.7026 -0.1471 + 4.1687 4.1687 4.1699 4.7109 4.7115 4.7115 5.0336 5.0336 + + k = 0.4250 0.4250 0.4250 ( 1640 PWs) bands (ev): + + -3.7632 -3.4505 -3.4505 -3.4490 -0.7667 -0.7665 -0.7665 -0.4300 + 4.4613 4.4613 4.4625 4.8133 4.8139 4.8139 5.0022 5.0022 + + k = 0.4500 0.4500 0.4500 ( 1625 PWs) bands (ev): + + -3.6162 -3.4671 -3.4671 -3.4656 -0.8142 -0.8139 -0.8139 -0.6543 + 4.7151 4.7151 4.7164 4.8932 4.8938 4.8938 4.9796 4.9796 + + k = 0.4750 0.4750 0.4750 ( 1637 PWs) bands (ev): + + -3.5158 -3.4769 -3.4769 -3.4754 -0.8434 -0.8431 -0.8431 -0.8014 + 4.8949 4.8949 4.8962 4.9437 4.9443 4.9443 4.9662 4.9662 + + k = 0.5000 0.5000 0.5000 ( 1640 PWs) bands (ev): + + -3.4801 -3.4801 -3.4801 -3.4782 -0.8533 -0.8529 -0.8529 -0.8529 + 4.9609 4.9609 4.9613 4.9613 4.9613 4.9625 4.9625 4.9625 + + k = 0.5063 0.4875 0.5063 ( 1640 PWs) bands (ev): + + -3.4837 -3.4803 -3.4797 -3.4781 -0.8525 -0.8512 -0.8510 -0.8471 + 4.9513 4.9538 4.9545 4.9595 4.9596 4.9598 4.9611 4.9626 + + k = 0.5125 0.4750 0.5125 ( 1640 PWs) bands (ev): + + -3.4954 -3.4810 -3.4801 -3.4754 -0.8507 -0.8455 -0.8453 -0.8296 + 4.9211 4.9316 4.9321 4.9538 4.9544 4.9550 4.9572 4.9649 + + k = 0.5188 0.4625 0.5188 ( 1636 PWs) bands (ev): + + -3.5147 -3.4821 -3.4811 -3.4703 -0.8479 -0.8361 -0.8359 -0.8008 + 4.8723 4.8955 4.8960 4.9441 4.9460 4.9467 4.9513 4.9689 + + k = 0.5250 0.4500 0.5250 ( 1627 PWs) bands (ev): + + -3.5411 -3.4835 -3.4826 -3.4631 -0.8440 -0.8229 -0.8227 -0.7611 + 4.8072 4.8469 4.8473 4.9312 4.9342 4.9350 4.9432 4.9746 + + k = 0.5313 0.4375 0.5313 ( 1625 PWs) bands (ev): + + -3.5738 -3.4854 -3.4844 -3.4539 -0.8390 -0.8061 -0.8060 -0.7113 + 4.7274 4.7869 4.7874 4.9142 4.9190 4.9198 4.9331 4.9820 + + k = 0.5375 0.4250 0.5375 ( 1625 PWs) bands (ev): + + -3.6122 -3.4875 -3.4865 -3.4426 -0.8329 -0.7858 -0.7856 -0.6520 + 4.6356 4.7176 4.7180 4.8939 4.9006 4.9014 4.9208 4.9908 + + k = 0.5438 0.4125 0.5438 ( 1621 PWs) bands (ev): + + -3.6555 -3.4898 -3.4889 -3.4293 -0.8258 -0.7620 -0.7618 -0.5841 + 4.5340 4.6404 4.6408 4.8705 4.8793 4.8801 4.9067 5.0016 + + k = 0.5500 0.4000 0.5500 ( 1625 PWs) bands (ev): + + -3.7031 -3.4923 -3.4914 -3.4139 -0.8178 -0.7349 -0.7347 -0.5082 + 4.4245 4.5567 4.5571 4.8441 4.8547 4.8555 4.8907 5.0136 + + k = 0.5563 0.3875 0.5563 ( 1633 PWs) bands (ev): + + -3.7541 -3.4949 -3.4940 -3.3965 -0.8089 -0.7045 -0.7044 -0.4250 + 4.3088 4.4680 4.4684 4.8150 4.8273 4.8281 4.8730 5.0271 + + k = 0.5625 0.3750 0.5625 ( 1629 PWs) bands (ev): + + -3.8080 -3.4975 -3.4966 -3.3770 -0.7991 -0.6711 -0.6710 -0.3353 + 4.1884 4.3756 4.3759 4.7836 4.7972 4.7980 4.8539 5.0422 + + k = 0.5688 0.3625 0.5688 ( 1633 PWs) bands (ev): + + -3.8641 -3.5001 -3.4991 -3.3556 -0.7887 -0.6349 -0.6347 -0.2396 + 4.0644 4.2801 4.2805 4.7500 4.7643 4.7651 4.8334 5.0587 + + k = 0.5750 0.3500 0.5750 ( 1633 PWs) bands (ev): + + -3.9219 -3.5024 -3.5015 -3.3321 -0.7775 -0.5959 -0.5958 -0.1385 + 3.9380 4.1827 4.1831 4.7146 4.7290 4.7298 4.8119 5.0768 + + k = 0.5813 0.3375 0.5813 ( 1637 PWs) bands (ev): + + -3.9810 -3.5045 -3.5036 -3.3066 -0.7658 -0.5544 -0.5543 -0.0325 + 3.8100 4.0841 4.0844 4.6777 4.6912 4.6920 4.7891 5.0963 + + k = 0.5875 0.3250 0.5875 ( 1633 PWs) bands (ev): + + -4.0409 -3.5063 -3.5054 -3.2791 -0.7538 -0.5106 -0.5105 0.0780 + 3.6810 3.9850 3.9854 4.6393 4.6513 4.6521 4.7655 5.1172 + + k = 0.5938 0.3125 0.5938 ( 1630 PWs) bands (ev): + + -4.1013 -3.5076 -3.5067 -3.2497 -0.7414 -0.4647 -0.4647 0.1926 + 3.5519 3.8861 3.8864 4.5999 4.6093 4.6102 4.7412 5.1396 + + k = 0.6000 0.3000 0.6000 ( 1632 PWs) bands (ev): + + -4.1619 -3.5084 -3.5076 -3.2183 -0.7291 -0.4170 -0.4170 0.3109 + 3.4227 3.7878 3.7881 4.5596 4.5654 4.5663 4.7162 5.1632 + + k = 0.6063 0.2875 0.6063 ( 1630 PWs) bands (ev): + + -4.2224 -3.5087 -3.5078 -3.1849 -0.7167 -0.3678 -0.3677 0.4327 + 3.2951 3.6906 3.6909 4.5186 4.5197 4.5205 4.6909 5.1882 + + k = 0.6125 0.2750 0.6125 ( 1631 PWs) bands (ev): + + -4.2826 -3.5082 -3.5074 -3.1496 -0.7048 -0.3172 -0.3172 0.5576 + 3.1689 3.5951 3.5954 4.4724 4.4732 4.4773 4.6653 5.2143 + + k = 0.6188 0.2625 0.6188 ( 1637 PWs) bands (ev): + + -4.3422 -3.5071 -3.5062 -3.1124 -0.6933 -0.2658 -0.2657 0.6854 + 3.0447 3.5014 3.5017 4.4234 4.4242 4.4357 4.6396 5.2417 + + k = 0.6250 0.2500 0.6250 ( 1638 PWs) bands (ev): + + -4.4012 -3.5051 -3.5042 -3.0734 -0.6828 -0.2137 -0.2137 0.8158 + 2.9232 3.4104 3.4107 4.3732 4.3741 4.3939 4.6140 5.2702 + + k = 0.6188 0.2500 0.6313 ( 1635 PWs) bands (ev): + + -4.4009 -3.5425 -3.4672 -3.0730 -0.6827 -0.2545 -0.1714 0.8159 + 2.9228 3.3674 3.4543 4.3582 4.3884 4.3922 4.6137 5.2673 + + k = 0.6125 0.2500 0.6375 ( 1635 PWs) bands (ev): + + -4.3998 -3.5806 -3.4303 -3.0720 -0.6824 -0.2937 -0.1277 0.8163 + 2.9213 3.3247 3.4984 4.3422 4.3871 4.4026 4.6126 5.2583 + + k = 0.6063 0.2500 0.6438 ( 1637 PWs) bands (ev): + + -4.3981 -3.6190 -3.3938 -3.0703 -0.6819 -0.3314 -0.0827 0.8168 + 2.9189 3.2826 3.5431 4.3254 4.3786 4.4160 4.6107 5.2435 + + k = 0.6000 0.2500 0.6500 ( 1639 PWs) bands (ev): + + -4.3957 -3.6575 -3.3580 -3.0680 -0.6813 -0.3674 -0.0363 0.8176 + 2.9154 3.2411 3.5881 4.3082 4.3669 4.4287 4.6079 5.2230 + + k = 0.5938 0.2500 0.6563 ( 1639 PWs) bands (ev): + + -4.3927 -3.6962 -3.3229 -3.0650 -0.6805 -0.4016 0.0114 0.8186 + 2.9109 3.2001 3.6337 4.2905 4.3519 4.4410 4.6045 5.1972 + + k = 0.5875 0.2500 0.6625 ( 1639 PWs) bands (ev): + + -4.3889 -3.7350 -3.2885 -3.0613 -0.6794 -0.4340 0.0602 0.8198 + 2.9053 3.1598 3.6795 4.2722 4.3345 4.4523 4.6002 5.1665 + + k = 0.5813 0.2500 0.6688 ( 1637 PWs) bands (ev): + + -4.3845 -3.7738 -3.2550 -3.0569 -0.6783 -0.4645 0.1102 0.8213 + 2.8986 3.1201 3.7256 4.2534 4.3146 4.4629 4.5951 5.1314 + + k = 0.5750 0.2500 0.6750 ( 1638 PWs) bands (ev): + + -4.3794 -3.8126 -3.2224 -3.0519 -0.6770 -0.4930 0.1614 0.8229 + 2.8906 3.0812 3.7720 4.2343 4.2924 4.4728 4.5889 5.0922 + + k = 0.5688 0.2500 0.6813 ( 1638 PWs) bands (ev): + + -4.3736 -3.8514 -3.1909 -3.0462 -0.6755 -0.5195 0.2136 0.8247 + 2.8815 3.0429 3.8185 4.2147 4.2686 4.4820 4.5817 5.0495 + + k = 0.5625 0.2500 0.6875 ( 1641 PWs) bands (ev): + + -4.3671 -3.8901 -3.1605 -3.0398 -0.6739 -0.5439 0.2669 0.8266 + 2.8709 3.0054 3.8653 4.1947 4.2432 4.4906 4.5732 5.0038 + + k = 0.5563 0.2500 0.6938 ( 1641 PWs) bands (ev): + + -4.3600 -3.9287 -3.1314 -3.0328 -0.6722 -0.5660 0.3213 0.8287 + 2.8589 2.9686 3.9121 4.1744 4.2168 4.4985 4.5634 4.9557 + + k = 0.5500 0.2500 0.7000 ( 1645 PWs) bands (ev): + + -4.3522 -3.9671 -3.1037 -3.0250 -0.6704 -0.5859 0.3765 0.8310 + 2.8454 2.9325 3.9590 4.1537 4.1895 4.5058 4.5518 4.9059 + + k = 0.5438 0.2500 0.7063 ( 1643 PWs) bands (ev): + + -4.3437 -4.0053 -3.0773 -3.0167 -0.6685 -0.6034 0.4328 0.8334 + 2.8303 2.8973 4.0057 4.1328 4.1619 4.5127 4.5381 4.8551 + + k = 0.5375 0.2500 0.7125 ( 1644 PWs) bands (ev): + + -4.3345 -4.0433 -3.0525 -3.0077 -0.6666 -0.6184 0.4900 0.8358 + 2.8135 2.8629 4.0523 4.1117 4.1342 4.5191 4.5216 4.8042 + + k = 0.5313 0.2500 0.7188 ( 1644 PWs) bands (ev): + + -4.3247 -4.0811 -3.0293 -2.9980 -0.6646 -0.6310 0.5481 0.8384 + 2.7951 2.8294 4.0903 4.0985 4.1067 4.5015 4.5255 4.7545 + + k = 0.5250 0.2500 0.7250 ( 1646 PWs) bands (ev): + + -4.3141 -4.1186 -3.0078 -2.9876 -0.6626 -0.6410 0.6071 0.8409 + 2.7749 2.7968 4.0687 4.0796 4.1441 4.4764 4.5318 4.7074 + + k = 0.5188 0.2500 0.7313 ( 1649 PWs) bands (ev): + + -4.3029 -4.1557 -2.9880 -2.9766 -0.6607 -0.6485 0.6669 0.8435 + 2.7526 2.7651 4.0471 4.0533 4.1887 4.4452 4.5384 4.6645 + + k = 0.5125 0.2500 0.7375 ( 1649 PWs) bands (ev): + + -4.2911 -4.1926 -2.9701 -2.9650 -0.6588 -0.6533 0.7275 0.8461 + 2.7288 2.7344 4.0253 4.0282 4.2319 4.4071 4.5458 4.6268 + + k = 0.5063 0.2500 0.7438 ( 1649 PWs) bands (ev): + + -4.2785 -4.2292 -2.9542 -2.9526 -0.6569 -0.6555 0.7889 0.8487 + 2.7031 2.7047 4.0034 4.0042 4.2730 4.3621 4.5547 4.5943 + + k = 0.5000 0.2500 0.7500 ( 1622 PWs) bands (ev): + + -4.2658 -4.2648 -2.9403 -2.9393 -0.6551 -0.6551 0.8511 0.8517 + 2.6754 2.6763 3.9815 3.9815 4.3116 4.3119 4.5659 4.5670 + + k = 0.5000 0.2625 0.7375 ( 1650 PWs) bands (ev): + + -4.2202 -4.2192 -2.9921 -2.9911 -0.6632 -0.6632 0.7215 0.7221 + 2.7915 2.7924 4.0681 4.0682 4.3461 4.3463 4.5927 4.5938 + + k = 0.5000 0.2750 0.7250 ( 1650 PWs) bands (ev): + + -4.1731 -4.1721 -3.0414 -3.0404 -0.6735 -0.6734 0.5937 0.5943 + 2.9134 2.9143 4.1524 4.1524 4.3832 4.3834 4.6202 4.6213 + + k = 0.5000 0.2875 0.7125 ( 1638 PWs) bands (ev): + + -4.1248 -4.1238 -3.0882 -3.0872 -0.6853 -0.6852 0.4679 0.4685 + 3.0409 3.0418 4.2339 4.2340 4.4220 4.4221 4.6480 4.6491 + + k = 0.5000 0.3000 0.7000 ( 1642 PWs) bands (ev): + + -4.0756 -4.0745 -3.1324 -3.1315 -0.6985 -0.6984 0.3445 0.3451 + 3.1723 3.1733 4.3123 4.3124 4.4622 4.4624 4.6758 4.6769 + + k = 0.5000 0.3125 0.6875 ( 1642 PWs) bands (ev): + + -4.0255 -4.0244 -3.1742 -3.1732 -0.7124 -0.7123 0.2240 0.2246 + 3.3075 3.3085 4.3873 4.3873 4.5035 4.5037 4.7034 4.7046 + + k = 0.5000 0.3250 0.6750 ( 1634 PWs) bands (ev): + + -3.9749 -3.9739 -3.2133 -3.2123 -0.7267 -0.7266 0.1068 0.1074 + 3.4457 3.4467 4.4586 4.4587 4.5457 4.5458 4.7308 4.7319 + + k = 0.5000 0.3375 0.6625 ( 1626 PWs) bands (ev): + + -3.9241 -3.9231 -3.2498 -3.2488 -0.7412 -0.7410 -0.0066 -0.0060 + 3.5863 3.5874 4.5262 4.5263 4.5882 4.5884 4.7576 4.7587 + + k = 0.5000 0.3500 0.6500 ( 1630 PWs) bands (ev): + + -3.8735 -3.8725 -3.2836 -3.2827 -0.7555 -0.7553 -0.1156 -0.1150 + 3.7282 3.7292 4.5892 4.5893 4.6309 4.6310 4.7836 4.7847 + + k = 0.5000 0.3625 0.6375 ( 1632 PWs) bands (ev): + + -3.8235 -3.8225 -3.3149 -3.3139 -0.7694 -0.7692 -0.2197 -0.2192 + 3.8705 3.8715 4.6478 4.6478 4.6730 4.6732 4.8087 4.8098 + + k = 0.5000 0.3750 0.6250 ( 1636 PWs) bands (ev): + + -3.7745 -3.7735 -3.3434 -3.3425 -0.7827 -0.7825 -0.3184 -0.3179 + 4.0122 4.0132 4.7016 4.7017 4.7145 4.7147 4.8326 4.8337 + + k = 0.5000 0.3875 0.6125 ( 1632 PWs) bands (ev): + + -3.7271 -3.7261 -3.3693 -3.3684 -0.7952 -0.7950 -0.4111 -0.4106 + 4.1521 4.1532 4.7508 4.7508 4.7546 4.7549 4.8551 4.8562 + + k = 0.5000 0.4000 0.6000 ( 1626 PWs) bands (ev): + + -3.6818 -3.6808 -3.3925 -3.3915 -0.8067 -0.8065 -0.4970 -0.4965 + 4.2887 4.2898 4.7928 4.7929 4.7949 4.7953 4.8760 4.8771 + + k = 0.5000 0.4125 0.5875 ( 1630 PWs) bands (ev): + + -3.6393 -3.6383 -3.4130 -3.4120 -0.8172 -0.8170 -0.5754 -0.5750 + 4.4202 4.4213 4.8287 4.8287 4.8340 4.8342 4.8947 4.8959 + + k = 0.5000 0.4250 0.5750 ( 1622 PWs) bands (ev): + + -3.6004 -3.5994 -3.4308 -3.4298 -0.8265 -0.8263 -0.6456 -0.6452 + 4.5444 4.5455 4.8615 4.8615 4.8679 4.8681 4.9117 4.9129 + + k = 0.5000 0.4375 0.5625 ( 1622 PWs) bands (ev): + + -3.5657 -3.5647 -3.4458 -3.4449 -0.8344 -0.8342 -0.7069 -0.7065 + 4.6586 4.6598 4.8906 4.8906 4.8965 4.8967 4.9264 4.9276 + + k = 0.5000 0.4500 0.5500 ( 1626 PWs) bands (ev): + + -3.5361 -3.5351 -3.4582 -3.4572 -0.8411 -0.8409 -0.7583 -0.7580 + 4.7594 4.7606 4.9154 4.9154 4.9200 4.9203 4.9387 4.9399 + + k = 0.5000 0.4625 0.5375 ( 1634 PWs) bands (ev): + + -3.5121 -3.5112 -3.4677 -3.4668 -0.8463 -0.8461 -0.7992 -0.7989 + 4.8436 4.8447 4.9350 4.9351 4.9383 4.9386 4.9483 4.9495 + + k = 0.5000 0.4750 0.5250 ( 1640 PWs) bands (ev): + + -3.4945 -3.4936 -3.4746 -3.4736 -0.8501 -0.8499 -0.8290 -0.8287 + 4.9075 4.9086 4.9494 4.9496 4.9510 4.9516 4.9554 4.9566 + + k = 0.5000 0.4875 0.5125 ( 1640 PWs) bands (ev): + + -3.4837 -3.4829 -3.4787 -3.4776 -0.8524 -0.8522 -0.8470 -0.8468 + 4.9474 4.9486 4.9581 4.9586 4.9588 4.9597 4.9598 4.9610 + + k = 0.5000 0.5000 0.5000 ( 1640 PWs) bands (ev): + + -3.4801 -3.4801 -3.4801 -3.4782 -0.8533 -0.8529 -0.8529 -0.8529 + 4.9609 4.9609 4.9613 4.9613 4.9613 4.9625 4.9625 4.9625 + + k = 0.4938 0.4938 0.5125 ( 1640 PWs) bands (ev): + + -3.4837 -3.4803 -3.4797 -3.4781 -0.8525 -0.8512 -0.8510 -0.8471 + 4.9513 4.9538 4.9545 4.9595 4.9596 4.9598 4.9611 4.9626 + + k = 0.4875 0.4875 0.5250 ( 1640 PWs) bands (ev): + + -3.4954 -3.4810 -3.4801 -3.4754 -0.8507 -0.8455 -0.8453 -0.8296 + 4.9211 4.9316 4.9321 4.9538 4.9544 4.9550 4.9572 4.9649 + + k = 0.4813 0.4813 0.5375 ( 1636 PWs) bands (ev): + + -3.5147 -3.4821 -3.4811 -3.4703 -0.8479 -0.8361 -0.8359 -0.8008 + 4.8723 4.8955 4.8960 4.9441 4.9460 4.9467 4.9513 4.9689 + + k = 0.4750 0.4750 0.5500 ( 1627 PWs) bands (ev): + + -3.5411 -3.4835 -3.4826 -3.4631 -0.8440 -0.8229 -0.8227 -0.7611 + 4.8072 4.8469 4.8473 4.9312 4.9342 4.9350 4.9432 4.9746 + + k = 0.4688 0.4688 0.5625 ( 1625 PWs) bands (ev): + + -3.5738 -3.4854 -3.4844 -3.4539 -0.8390 -0.8061 -0.8060 -0.7113 + 4.7274 4.7869 4.7874 4.9142 4.9190 4.9198 4.9331 4.9820 + + k = 0.4625 0.4625 0.5750 ( 1625 PWs) bands (ev): + + -3.6122 -3.4875 -3.4865 -3.4426 -0.8329 -0.7858 -0.7856 -0.6520 + 4.6356 4.7176 4.7180 4.8939 4.9006 4.9014 4.9208 4.9908 + + k = 0.4563 0.4563 0.5875 ( 1621 PWs) bands (ev): + + -3.6555 -3.4898 -3.4889 -3.4293 -0.8258 -0.7620 -0.7618 -0.5841 + 4.5340 4.6404 4.6408 4.8705 4.8793 4.8801 4.9067 5.0016 + + k = 0.4500 0.4500 0.6000 ( 1625 PWs) bands (ev): + + -3.7031 -3.4923 -3.4914 -3.4139 -0.8178 -0.7349 -0.7347 -0.5082 + 4.4245 4.5567 4.5571 4.8441 4.8547 4.8555 4.8907 5.0136 + + k = 0.4438 0.4438 0.6125 ( 1633 PWs) bands (ev): + + -3.7541 -3.4949 -3.4940 -3.3965 -0.8089 -0.7045 -0.7044 -0.4250 + 4.3088 4.4680 4.4684 4.8150 4.8273 4.8281 4.8730 5.0271 + + k = 0.4375 0.4375 0.6250 ( 1629 PWs) bands (ev): + + -3.8080 -3.4975 -3.4966 -3.3770 -0.7991 -0.6711 -0.6710 -0.3353 + 4.1884 4.3756 4.3759 4.7836 4.7972 4.7980 4.8539 5.0422 + + k = 0.4313 0.4313 0.6375 ( 1633 PWs) bands (ev): + + -3.8641 -3.5001 -3.4991 -3.3556 -0.7887 -0.6349 -0.6347 -0.2396 + 4.0644 4.2801 4.2805 4.7500 4.7643 4.7651 4.8334 5.0587 + + k = 0.4250 0.4250 0.6500 ( 1633 PWs) bands (ev): + + -3.9219 -3.5024 -3.5015 -3.3321 -0.7775 -0.5959 -0.5958 -0.1385 + 3.9380 4.1827 4.1831 4.7146 4.7290 4.7298 4.8119 5.0768 + + k = 0.4188 0.4188 0.6625 ( 1637 PWs) bands (ev): + + -3.9810 -3.5045 -3.5036 -3.3066 -0.7658 -0.5544 -0.5543 -0.0325 + 3.8100 4.0841 4.0844 4.6777 4.6912 4.6920 4.7891 5.0963 + + k = 0.4125 0.4125 0.6750 ( 1633 PWs) bands (ev): + + -4.0409 -3.5063 -3.5054 -3.2791 -0.7538 -0.5106 -0.5105 0.0780 + 3.6810 3.9850 3.9854 4.6393 4.6513 4.6521 4.7655 5.1172 + + k = 0.4063 0.4063 0.6875 ( 1630 PWs) bands (ev): + + -4.1013 -3.5076 -3.5067 -3.2497 -0.7414 -0.4647 -0.4647 0.1926 + 3.5519 3.8861 3.8864 4.5999 4.6093 4.6102 4.7412 5.1396 + + k = 0.4000 0.4000 0.7000 ( 1632 PWs) bands (ev): + + -4.1619 -3.5084 -3.5076 -3.2183 -0.7291 -0.4170 -0.4170 0.3109 + 3.4227 3.7878 3.7881 4.5596 4.5654 4.5663 4.7162 5.1632 + + k = 0.3938 0.3938 0.7125 ( 1630 PWs) bands (ev): + + -4.2224 -3.5087 -3.5078 -3.1849 -0.7167 -0.3678 -0.3677 0.4327 + 3.2951 3.6906 3.6909 4.5186 4.5197 4.5205 4.6909 5.1882 + + k = 0.3875 0.3875 0.7250 ( 1631 PWs) bands (ev): + + -4.2826 -3.5082 -3.5074 -3.1496 -0.7048 -0.3172 -0.3172 0.5576 + 3.1689 3.5951 3.5954 4.4724 4.4732 4.4773 4.6653 5.2143 + + k = 0.3813 0.3813 0.7375 ( 1637 PWs) bands (ev): + + -4.3422 -3.5071 -3.5062 -3.1124 -0.6933 -0.2658 -0.2657 0.6854 + 3.0447 3.5014 3.5017 4.4234 4.4242 4.4357 4.6396 5.2417 + + k = 0.3750 0.3750 0.7500 ( 1638 PWs) bands (ev): + + -4.4012 -3.5051 -3.5042 -3.0734 -0.6828 -0.2137 -0.2137 0.8158 + 2.9232 3.4104 3.4107 4.3732 4.3741 4.3939 4.6140 5.2702 + + k = 0.3875 0.3688 0.7438 ( 1634 PWs) bands (ev): + + -4.3710 -3.5618 -3.4506 -3.0924 -0.6877 -0.2993 -0.1768 0.7505 + 2.9825 3.3911 3.5213 4.3762 4.4110 4.4200 4.6260 5.2492 + + k = 0.4000 0.3625 0.7375 ( 1633 PWs) bands (ev): + + -4.3392 -3.6180 -3.3994 -3.1094 -0.6924 -0.3790 -0.1384 0.6865 + 3.0397 3.3737 3.6337 4.3785 4.4208 4.4633 4.6361 5.2149 + + k = 0.4125 0.3563 0.7313 ( 1634 PWs) bands (ev): + + -4.3056 -3.6732 -3.3515 -3.1244 -0.6967 -0.4519 -0.0986 0.6237 + 3.0940 3.3583 3.7470 4.3806 4.4244 4.5028 4.6438 5.1680 + + k = 0.4250 0.3500 0.7250 ( 1632 PWs) bands (ev): + + -4.2703 -3.7272 -3.3078 -3.1375 -0.7007 -0.5174 -0.0572 0.5622 + 3.1445 3.3451 3.8607 4.3824 4.4227 4.5388 4.6491 5.1099 + + k = 0.4375 0.3438 0.7188 ( 1636 PWs) bands (ev): + + -4.2334 -3.7801 -3.2691 -3.1485 -0.7041 -0.5747 -0.0143 0.5022 + 3.1903 3.3338 3.9744 4.3839 4.4173 4.5714 4.6511 5.0420 + + k = 0.4500 0.3375 0.7125 ( 1637 PWs) bands (ev): + + -4.1949 -3.8317 -3.2360 -3.1576 -0.7070 -0.6230 0.0302 0.4436 + 3.2303 3.3245 4.0875 4.3851 4.4097 4.6006 4.6487 4.9666 + + k = 0.4625 0.3313 0.7063 ( 1637 PWs) bands (ev): + + -4.1547 -3.8821 -3.2093 -3.1646 -0.7093 -0.6615 0.0763 0.3864 + 3.2633 3.3173 4.1990 4.3861 4.4013 4.6269 4.6398 4.8871 + + k = 0.4750 0.3250 0.7000 ( 1635 PWs) bands (ev): + + -4.1130 -3.9311 -3.1897 -3.1696 -0.7110 -0.6895 0.1240 0.3308 + 3.2877 3.3122 4.3076 4.3868 4.3940 4.6191 4.6514 4.8099 + + k = 0.4875 0.3188 0.6938 ( 1637 PWs) bands (ev): + + -4.0697 -3.9787 -3.1778 -3.1726 -0.7120 -0.7066 0.1733 0.2767 + 3.3028 3.3091 4.3872 4.3891 4.4108 4.5758 4.6755 4.7462 + + k = 0.5000 0.3125 0.6875 ( 1642 PWs) bands (ev): + + -4.0255 -4.0244 -3.1742 -3.1732 -0.7124 -0.7123 0.2240 0.2246 + 3.3075 3.3085 4.3873 4.3873 4.5035 4.5037 4.7034 4.7046 + + k = 0.5125 0.3063 0.6813 ( 1637 PWs) bands (ev): + + -4.0697 -3.9787 -3.1778 -3.1726 -0.7120 -0.7066 0.1733 0.2767 + 3.3028 3.3091 4.3872 4.3891 4.4108 4.5758 4.6755 4.7462 + + k = 0.5250 0.3000 0.6750 ( 1635 PWs) bands (ev): + + -4.1130 -3.9311 -3.1897 -3.1696 -0.7110 -0.6895 0.1240 0.3308 + 3.2877 3.3122 4.3076 4.3868 4.3940 4.6191 4.6514 4.8099 + + k = 0.5375 0.2938 0.6688 ( 1637 PWs) bands (ev): + + -4.1547 -3.8821 -3.2093 -3.1646 -0.7093 -0.6615 0.0763 0.3864 + 3.2633 3.3173 4.1990 4.3861 4.4013 4.6269 4.6398 4.8871 + + k = 0.5500 0.2875 0.6625 ( 1637 PWs) bands (ev): + + -4.1949 -3.8317 -3.2360 -3.1576 -0.7070 -0.6230 0.0302 0.4436 + 3.2303 3.3245 4.0875 4.3851 4.4097 4.6006 4.6487 4.9666 + + k = 0.5625 0.2813 0.6563 ( 1636 PWs) bands (ev): + + -4.2334 -3.7801 -3.2691 -3.1485 -0.7041 -0.5747 -0.0143 0.5022 + 3.1903 3.3338 3.9744 4.3839 4.4173 4.5714 4.6511 5.0420 + + k = 0.5750 0.2750 0.6500 ( 1632 PWs) bands (ev): + + -4.2703 -3.7272 -3.3078 -3.1375 -0.7007 -0.5174 -0.0572 0.5622 + 3.1445 3.3451 3.8607 4.3824 4.4227 4.5388 4.6491 5.1099 + + k = 0.5875 0.2688 0.6438 ( 1634 PWs) bands (ev): + + -4.3056 -3.6732 -3.3515 -3.1244 -0.6967 -0.4519 -0.0986 0.6237 + 3.0940 3.3583 3.7470 4.3806 4.4244 4.5028 4.6438 5.1680 + + k = 0.6000 0.2625 0.6375 ( 1633 PWs) bands (ev): + + -4.3392 -3.6180 -3.3994 -3.1094 -0.6924 -0.3790 -0.1384 0.6865 + 3.0397 3.3737 3.6337 4.3785 4.4208 4.4633 4.6361 5.2149 + + k = 0.6125 0.2563 0.6313 ( 1634 PWs) bands (ev): + + -4.3710 -3.5618 -3.4506 -3.0924 -0.6877 -0.2993 -0.1768 0.7505 + 2.9825 3.3911 3.5213 4.3762 4.4110 4.4200 4.6260 5.2492 + + k = 0.6250 0.2500 0.6250 ( 1638 PWs) bands (ev): + + -4.4012 -3.5051 -3.5042 -3.0734 -0.6828 -0.2137 -0.2137 0.8158 + 2.9232 3.4104 3.4107 4.3732 4.3741 4.3939 4.6140 5.2702 + + k = 0.6188 0.2375 0.6188 ( 1634 PWs) bands (ev): + + -4.3869 -3.5297 -3.5289 -3.0656 -0.6714 -0.1659 -0.1659 0.8217 + 2.8630 3.3795 3.3797 4.3855 4.3864 4.4030 4.4913 5.2715 + + k = 0.6125 0.2250 0.6125 ( 1630 PWs) bands (ev): + + -4.3707 -3.5535 -3.5526 -3.0661 -0.6486 -0.1163 -0.1163 0.8281 + 2.8043 3.3386 3.3388 4.3633 4.4032 4.4041 4.4135 5.2689 + + k = 0.6063 0.2125 0.6063 ( 1637 PWs) bands (ev): + + -4.3526 -3.5763 -3.5754 -3.0745 -0.6150 -0.0651 -0.0651 0.8349 + 2.7473 3.2888 3.2889 4.2315 4.4254 4.4257 4.4264 5.2626 + + k = 0.6000 0.2000 0.6000 ( 1639 PWs) bands (ev): + + -4.3325 -3.5980 -3.5972 -3.0903 -0.5712 -0.0126 -0.0126 0.8421 + 2.6923 3.2315 3.2316 4.0971 4.4393 4.4517 4.4527 5.2528 + + k = 0.5938 0.1875 0.5938 ( 1626 PWs) bands (ev): + + -4.3105 -3.6187 -3.6179 -3.1126 -0.5181 0.0412 0.0413 0.8497 + 2.6393 3.1686 3.1687 3.9614 4.4544 4.4810 4.4820 5.2400 + + k = 0.5875 0.1750 0.5875 ( 1622 PWs) bands (ev): + + -4.2867 -3.6382 -3.6374 -3.1408 -0.4566 0.0960 0.0961 0.8569 + 2.5886 3.1013 3.1013 3.8249 4.4711 4.5126 4.5136 5.2240 + + k = 0.5813 0.1625 0.5813 ( 1628 PWs) bands (ev): + + -4.2610 -3.6566 -3.6558 -3.1740 -0.3880 0.1514 0.1514 0.8638 + 2.5404 3.0309 3.0309 3.6883 4.4890 4.5453 4.5464 5.2052 + + k = 0.5750 0.1500 0.5750 ( 1636 PWs) bands (ev): + + -4.2335 -3.6738 -3.6730 -3.2113 -0.3131 0.2070 0.2070 0.8701 + 2.4950 2.9584 2.9585 3.5532 4.5084 4.5786 4.5796 5.1839 + + k = 0.5688 0.1375 0.5688 ( 1638 PWs) bands (ev): + + -4.2042 -3.6898 -3.6890 -3.2521 -0.2331 0.2625 0.2626 0.8753 + 2.4527 2.8855 2.8856 3.4199 4.5292 4.6118 4.6128 5.1606 + + k = 0.5625 0.1250 0.5625 ( 1632 PWs) bands (ev): + + -4.1731 -3.7044 -3.7036 -3.2955 -0.1488 0.3176 0.3177 0.8790 + 2.4140 2.8131 2.8131 3.2896 4.5513 4.6443 4.6453 5.1352 + + k = 0.5563 0.1125 0.5563 ( 1636 PWs) bands (ev): + + -4.1402 -3.7178 -3.7170 -3.3411 -0.0618 0.3715 0.3716 0.8806 + 2.3790 2.7421 2.7421 3.1630 4.5746 4.6755 4.6766 5.1082 + + k = 0.5500 0.1000 0.5500 ( 1638 PWs) bands (ev): + + -4.1057 -3.7298 -3.7290 -3.3882 0.0273 0.4237 0.4238 0.8795 + 2.3486 2.6737 2.6738 3.0409 4.5992 4.7049 4.7059 5.0801 + + k = 0.5438 0.0875 0.5438 ( 1636 PWs) bands (ev): + + -4.0695 -3.7405 -3.7397 -3.4364 0.1172 0.4733 0.4734 0.8748 + 2.3233 2.6091 2.6091 2.9246 4.6250 4.7320 4.7331 5.0505 + + k = 0.5375 0.0750 0.5375 ( 1636 PWs) bands (ev): + + -4.0318 -3.7498 -3.7490 -3.4852 0.2069 0.5195 0.5197 0.8657 + 2.3038 2.5493 2.5494 2.8150 4.6518 4.7565 4.7576 5.0199 + + k = 0.5313 0.0625 0.5313 ( 1634 PWs) bands (ev): + + -3.9925 -3.7577 -3.7569 -3.5343 0.2950 0.5614 0.5616 0.8514 + 2.2909 2.4957 2.4958 2.7133 4.6795 4.7782 4.7793 4.9888 + + k = 0.5250 0.0500 0.5250 ( 1636 PWs) bands (ev): + + -3.9517 -3.7641 -3.7634 -3.5835 0.3803 0.5979 0.5980 0.8306 + 2.2856 2.4493 2.4495 2.6207 4.7081 4.7962 4.7972 4.9572 + + k = 0.5188 0.0375 0.5188 ( 1636 PWs) bands (ev): + + -3.9095 -3.7692 -3.7684 -3.6323 0.4616 0.6277 0.6279 0.8026 + 2.2889 2.4116 2.4118 2.5384 4.7375 4.8105 4.8115 4.9254 + + k = 0.5125 0.0250 0.5125 ( 1636 PWs) bands (ev): + + -3.8659 -3.7728 -3.7720 -3.6807 0.5375 0.6500 0.6502 0.7665 + 2.3019 2.3837 2.3838 2.4672 4.7677 4.8209 4.8219 4.8935 + + k = 0.5063 0.0125 0.5063 ( 1633 PWs) bands (ev): + + -3.8212 -3.7750 -3.7742 -3.7284 0.6069 0.6638 0.6639 0.7218 + 2.3256 2.3665 2.3666 2.4079 4.7987 4.8272 4.8283 4.8616 + + k = 0.5000 0.0000 0.5000 ( 1628 PWs) bands (ev): + + -3.7759 -3.7757 -3.7757 -3.7739 0.6684 0.6684 0.6685 0.6687 + 2.3603 2.3608 2.3608 2.3611 4.8292 4.8297 4.8305 4.8305 + + Writing output data file /home/ponet/.julia/environments/DFControlDEV/outputs/Si.save/ + + init_run : 0.13s CPU 0.13s WALL ( 1 calls) + electrons : 10.67s CPU 10.76s WALL ( 1 calls) + + Called by init_run: + wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) + wfcinit:atom : 0.01s CPU 0.02s WALL ( 56 calls) + wfcinit:wfcr : 0.68s CPU 0.69s WALL ( 56 calls) + potinit : 0.05s CPU 0.05s WALL ( 1 calls) + hinit0 : 0.06s CPU 0.06s WALL ( 1 calls) + + Called by electrons: + c_bands : 10.67s CPU 10.75s WALL ( 1 calls) + v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) + v_h : 0.00s CPU 0.00s WALL ( 1 calls) + v_xc : 0.01s CPU 0.01s WALL ( 1 calls) + newd : 0.00s CPU 0.00s WALL ( 1 calls) + PAW_pot : 0.04s CPU 0.04s WALL ( 1 calls) + + Called by c_bands: + init_us_2 : 0.02s CPU 0.02s WALL ( 56 calls) + cegterg : 9.07s CPU 9.13s WALL ( 112 calls) + + Called by sum_band: + + Called by *egterg: + cdiaghg : 0.32s CPU 0.33s WALL ( 1533 calls) + cegterg:over : 0.39s CPU 0.39s WALL ( 1477 calls) + cegterg:upda : 0.21s CPU 0.21s WALL ( 1477 calls) + cegterg:last : 0.53s CPU 0.53s WALL ( 1272 calls) + h_psi : 7.65s CPU 7.71s WALL ( 1645 calls) + s_psi : 0.40s CPU 0.41s WALL ( 1645 calls) + g_psi : 0.09s CPU 0.09s WALL ( 1477 calls) + + Called by h_psi: + h_psi:calbec : 0.46s CPU 0.47s WALL ( 1645 calls) + vloc_psi : 6.72s CPU 6.77s WALL ( 1645 calls) + add_vuspsi : 0.42s CPU 0.43s WALL ( 1645 calls) + + General routines + calbec : 0.46s CPU 0.46s WALL ( 1645 calls) + fft : 0.00s CPU 0.01s WALL ( 12 calls) + fftw : 5.90s CPU 5.95s WALL ( 45210 calls) + davcio : 0.01s CPU 0.01s WALL ( 112 calls) + + Parallel routines + + PAW routines + PAW_pot : 0.04s CPU 0.04s WALL ( 1 calls) + + PWSCF : 10.91s CPU 11.05s WALL + + + This run was terminated on: 0:13:47 16Jun2021 + +=------------------------------------------------------------------------------= + JOB DONE. +=------------------------------------------------------------------------------= diff --git a/docs/src/assets/job/Job2/job.tt b/docs/src/assets/job/Job2/job.tt new file mode 100644 index 00000000..b6c5dfb0 --- /dev/null +++ b/docs/src/assets/job/Job2/job.tt @@ -0,0 +1,7 @@ +#!/bin/bash +#SBATCH -J Si + +#mpirun -np 4 /opt/qe/bin/pw.x -nk 4 < scf.in > scf.out +mpirun -np 4 /opt/qe/bin/pw.x -nk 4 < bands.in > bands.out +mpirun -np 4 /opt/qe/bin/pw.x -nk 4 < nscf.in > nscf.out +mpirun -np 4 /opt/qe/bin/projwfc.x < projwfc.in > projwfc.out diff --git a/docs/src/assets/job/Job2/nscf.in b/docs/src/assets/job/Job2/nscf.in new file mode 100644 index 00000000..ad7b637b --- /dev/null +++ b/docs/src/assets/job/Job2/nscf.in @@ -0,0 +1,256 @@ +&control + prefix = 'Si' + verbosity = 'high' + calculation = 'nscf' + outdir = '/home/ponet/.julia/dev/DFControl/docs/build/guide/Job2/outputs' + pseudo_dir = '/home/ponet/Documents/pseudos/pslibrary_pbesol/PSEUDOPOTENTIALS' +/ + +&system + ibrav = 0 + nat = 8 + ntyp = 1 + ecutwfc = 20.0 +/ + +&electrons + conv_thr = 1.0e-6 +/ + +ATOMIC_SPECIES +Si 28.0855 Si.pbesol-n-kjpaw_psl.0.1.UPF + +CELL_PARAMETERS (angstrom) +5.4309401512146 0.0 0.0 +0.0 5.4309401512146 0.0 +0.0 0.0 5.4309401512146 + +ATOMIC_POSITIONS (crystal) +Si 0.0 0.0 0.0 +Si 0.0 0.5 0.5 +Si 0.25 0.25 0.25 +Si 0.5 0.0 0.5 +Si 0.25 0.75 0.75 +Si 0.75 0.75 0.25 +Si 0.75 0.25 0.75 +Si 0.5 0.5 0.0 + +K_POINTS (crystal) +216 + 0.0 0.0 0.0 0.004629629629629629 + 0.16666666666666666 0.0 0.0 0.004629629629629629 + 0.3333333333333333 0.0 0.0 0.004629629629629629 + 0.5 0.0 0.0 0.004629629629629629 + 0.6666666666666666 0.0 0.0 0.004629629629629629 + 0.8333333333333334 0.0 0.0 0.004629629629629629 + 0.0 0.16666666666666666 0.0 0.004629629629629629 + 0.16666666666666666 0.16666666666666666 0.0 0.004629629629629629 + 0.3333333333333333 0.16666666666666666 0.0 0.004629629629629629 + 0.5 0.16666666666666666 0.0 0.004629629629629629 + 0.6666666666666666 0.16666666666666666 0.0 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open-source Quantum ESPRESSO suite + for quantum simulation of materials; please cite + "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); + "P. Giannozzi et al., J. Phys.:Condens. Matter 29 465901 (2017); + "P. Giannozzi et al., J. Chem. Phys. 152 154105 (2020); + URL http://www.quantum-espresso.org", + in publications or presentations arising from this work. More details at + http://www.quantum-espresso.org/quote + + Parallel version (MPI), running on 4 processors + + MPI processes distributed on 1 nodes + K-points division: npool = 4 + Waiting for input... + Reading input from standard input + + Current dimensions of program PWSCF are: + Max number of different atomic species (ntypx) = 10 + Max number of k-points (npk) = 40000 + Max angular momentum in pseudopotentials (lmaxx) = 3 + + Atomic positions and unit cell read from directory: + /home/ponet/.julia/dev/DFControl/docs/build/guide/Job2/outputs/Si.save/ + + file Si.pbesol-n-kjpaw_psl.0.1.UPF: wavefunction(s) 3S renormalized + Found symmetry operation: I + ( 0.0000 -0.5000 -0.5000) + This is a supercell, fractional translations are disabled + Message from routine setup: + using ibrav=0 with symmetry is DISCOURAGED, use correct ibrav instead + + Subspace diagonalization in iterative solution of the eigenvalue problem: + a serial algorithm will be used + + + G-vector sticks info + -------------------- + sticks: dense smooth PW G-vecs: dense smooth PW + Sum 673 673 241 13133 13133 2801 + + Using Slab Decomposition + + + + bravais-lattice index = 0 + lattice parameter (alat) = 10.2630 a.u. + unit-cell volume = 1080.9899 (a.u.)^3 + number of atoms/cell = 8 + number of atomic types = 1 + number of electrons = 32.00 + number of Kohn-Sham states= 16 + kinetic-energy cutoff = 20.0000 Ry + charge density cutoff = 80.0000 Ry + Exchange-correlation= SLA PW PSX PSC + ( 1 4 10 8 0 0 0) + + celldm(1)= 10.262989 celldm(2)= 0.000000 celldm(3)= 0.000000 + celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 + + crystal axes: (cart. coord. in units of alat) + a(1) = ( 1.000000 0.000000 0.000000 ) + a(2) = ( 0.000000 1.000000 0.000000 ) + a(3) = ( 0.000000 0.000000 1.000000 ) + + reciprocal axes: (cart. coord. in units 2 pi/alat) + b(1) = ( 1.000000 0.000000 0.000000 ) + b(2) = ( 0.000000 1.000000 0.000000 ) + b(3) = ( 0.000000 0.000000 1.000000 ) + + + PseudoPot. # 1 for Si read from file: + /home/ponet/Documents/pseudos/pslibrary_pbesol/PSEUDOPOTENTIALS/Si.pbesol-n-kjpaw_psl.0.1.UPF + MD5 check sum: e112a9414d22b310a654c074e8da067c + Pseudo is Projector augmented-wave + core cor, Zval = 4.0 + Generated using "atomic" code by A. Dal Corso v.5.0.99 svn rev. 10869 + Shape of augmentation charge: PSQ + Using radial grid of 1141 points, 4 beta functions with: + l(1) = 0 + l(2) = 0 + l(3) = 1 + l(4) = 1 + Q(r) pseudized with 0 coefficients + + + atomic species valence mass pseudopotential + Si 4.00 28.08550 Si( 1.00) + + 24 Sym. Ops. (no inversion) found + + + s frac. trans. + + isym = 1 identity + + cryst. s( 1) = ( 1 0 0 ) + ( 0 1 0 ) + ( 0 0 1 ) + + cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + + + isym = 2 180 deg rotation - cart. axis [0,0,1] + + cryst. s( 2) = ( -1 0 0 ) + ( 0 -1 0 ) + ( 0 0 1 ) + + cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + + + isym = 3 180 deg rotation - cart. axis [0,1,0] + + cryst. s( 3) = ( -1 0 0 ) + ( 0 1 0 ) + ( 0 0 -1 ) + + cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + + + isym = 4 180 deg rotation - cart. axis [1,0,0] + + cryst. s( 4) = ( 1 0 0 ) + ( 0 -1 0 ) + ( 0 0 -1 ) + + cart. s( 4) = ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + + + isym = 5 120 deg rotation - cart. axis [-1,-1,-1] + + cryst. s( 5) = ( 0 0 1 ) + ( 1 0 0 ) + ( 0 1 0 ) + + cart. s( 5) = ( 0.0000000 1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + + + isym = 6 120 deg rotation - cart. axis [-1,1,1] + + cryst. s( 6) = ( 0 0 -1 ) + ( -1 0 0 ) + ( 0 1 0 ) + + cart. s( 6) = ( 0.0000000 -1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + + + isym = 7 120 deg rotation - cart. axis [1,1,-1] + + cryst. s( 7) = ( 0 0 -1 ) + ( 1 0 0 ) + ( 0 -1 0 ) + + cart. s( 7) = ( 0.0000000 1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + + + isym = 8 120 deg rotation - cart. axis [1,-1,1] + + cryst. s( 8) = ( 0 0 1 ) + ( -1 0 0 ) + ( 0 -1 0 ) + + cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + + + isym = 9 120 deg rotation - cart. axis [1,1,1] + + cryst. s( 9) = ( 0 1 0 ) + ( 0 0 1 ) + ( 1 0 0 ) + + cart. s( 9) = ( 0.0000000 0.0000000 1.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + + + isym = 10 120 deg rotation - cart. axis [-1,1,-1] + + cryst. s(10) = ( 0 -1 0 ) + ( 0 0 -1 ) + ( 1 0 0 ) + + cart. s(10) = ( 0.0000000 0.0000000 1.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + + + isym = 11 120 deg rotation - cart. axis [1,-1,-1] + + cryst. s(11) = ( 0 -1 0 ) + ( 0 0 1 ) + ( -1 0 0 ) + + cart. s(11) = ( 0.0000000 0.0000000 -1.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + + + isym = 12 120 deg rotation - cart. axis [-1,-1,1] + + cryst. s(12) = ( 0 1 0 ) + ( 0 0 -1 ) + ( -1 0 0 ) + + cart. s(12) = ( 0.0000000 0.0000000 -1.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + + + isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] + + cryst. s(13) = ( 0 -1 0 ) + ( -1 0 0 ) + ( 0 0 1 ) + + cart. s(13) = ( 0.0000000 -1.0000000 0.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + + + isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] + + cryst. s(14) = ( 0 1 0 ) + ( 1 0 0 ) + ( 0 0 1 ) + + cart. s(14) = ( 0.0000000 1.0000000 0.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + + + isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] + + cryst. s(15) = ( 0 1 0 ) + ( -1 0 0 ) + ( 0 0 -1 ) + + cart. s(15) = ( 0.0000000 -1.0000000 0.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + + + isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] + + cryst. s(16) = ( 0 -1 0 ) + ( 1 0 0 ) + ( 0 0 -1 ) + + cart. s(16) = ( 0.0000000 1.0000000 0.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + + + isym = 17 inv. 180 deg rotation - cart. axis [1,0,1] + + cryst. s(17) = ( 0 0 -1 ) + ( 0 1 0 ) + ( -1 0 0 ) + + cart. s(17) = ( 0.0000000 0.0000000 -1.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + + + isym = 18 inv. 180 deg rotation - cart. axis [-1,0,1] + + cryst. s(18) = ( 0 0 1 ) + ( 0 1 0 ) + ( 1 0 0 ) + + cart. s(18) = ( 0.0000000 0.0000000 1.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + + + isym = 19 inv. 90 deg rotation - cart. axis [0,1,0] + + cryst. s(19) = ( 0 0 1 ) + ( 0 -1 0 ) + ( -1 0 0 ) + + cart. s(19) = ( 0.0000000 0.0000000 -1.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + ( 1.0000000 0.0000000 0.0000000 ) + + + isym = 20 inv. 90 deg rotation - cart. axis [0,-1,0] + + cryst. s(20) = ( 0 0 -1 ) + ( 0 -1 0 ) + ( 1 0 0 ) + + cart. s(20) = ( 0.0000000 0.0000000 1.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + ( -1.0000000 0.0000000 0.0000000 ) + + + isym = 21 inv. 180 deg rotation - cart. axis [0,1,1] + + cryst. s(21) = ( 1 0 0 ) + ( 0 0 -1 ) + ( 0 -1 0 ) + + cart. s(21) = ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + + + isym = 22 inv. 180 deg rotation - cart. axis [0,1,-1] + + cryst. s(22) = ( 1 0 0 ) + ( 0 0 1 ) + ( 0 1 0 ) + + cart. s(22) = ( 1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + + + isym = 23 inv. 90 deg rotation - cart. axis [-1,0,0] + + cryst. s(23) = ( -1 0 0 ) + ( 0 0 1 ) + ( 0 -1 0 ) + + cart. s(23) = ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 -1.0000000 ) + ( 0.0000000 1.0000000 0.0000000 ) + + + isym = 24 inv. 90 deg rotation - cart. axis [1,0,0] + + cryst. s(24) = ( -1 0 0 ) + ( 0 0 -1 ) + ( 0 1 0 ) + + cart. s(24) = ( -1.0000000 0.0000000 0.0000000 ) + ( 0.0000000 0.0000000 1.0000000 ) + ( 0.0000000 -1.0000000 0.0000000 ) + + + Cartesian axes + + site n. atom positions (alat units) + 1 Si tau( 1) = ( 0.0000000 0.0000000 0.0000000 ) + 2 Si tau( 2) = ( 0.0000000 0.5000000 0.5000000 ) + 3 Si tau( 3) = ( 0.2500000 0.2500000 0.2500000 ) + 4 Si tau( 4) = ( 0.5000000 0.0000000 0.5000000 ) + 5 Si tau( 5) = ( 0.2500000 0.7500000 0.7500000 ) + 6 Si tau( 6) = ( 0.7500000 0.7500000 0.2500000 ) + 7 Si tau( 7) = ( 0.7500000 0.2500000 0.7500000 ) + 8 Si tau( 8) = ( 0.5000000 0.5000000 0.0000000 ) + + Crystallographic axes + + site n. atom positions (cryst. coord.) + 1 Si tau( 1) = ( 0.0000000 0.0000000 0.0000000 ) + 2 Si tau( 2) = ( 0.0000000 0.5000000 0.5000000 ) + 3 Si tau( 3) = ( 0.2500000 0.2500000 0.2500000 ) + 4 Si tau( 4) = ( 0.5000000 0.0000000 0.5000000 ) + 5 Si tau( 5) = ( 0.2500000 0.7500000 0.7500000 ) + 6 Si tau( 6) = ( 0.7500000 0.7500000 0.2500000 ) + 7 Si tau( 7) = ( 0.7500000 0.2500000 0.7500000 ) + 8 Si tau( 8) = ( 0.5000000 0.5000000 0.0000000 ) + + number of k points= 216 + cart. coord. in units 2pi/alat + k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0092593 + k( 2) = ( 0.1666667 0.0000000 0.0000000), wk = 0.0092593 + k( 3) = ( 0.3333333 0.0000000 0.0000000), wk = 0.0092593 + k( 4) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0092593 + k( 5) = ( 0.6666667 0.0000000 0.0000000), wk = 0.0092593 + k( 6) = ( 0.8333333 0.0000000 0.0000000), wk = 0.0092593 + k( 7) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0092593 + k( 8) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0092593 + k( 9) = ( 0.3333333 0.1666667 0.0000000), wk = 0.0092593 + k( 10) = ( 0.5000000 0.1666667 0.0000000), wk = 0.0092593 + k( 11) = ( 0.6666667 0.1666667 0.0000000), wk = 0.0092593 + k( 12) = ( 0.8333333 0.1666667 0.0000000), wk = 0.0092593 + k( 13) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0092593 + k( 14) = ( 0.1666667 0.3333333 0.0000000), wk = 0.0092593 + k( 15) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0092593 + k( 16) = ( 0.5000000 0.3333333 0.0000000), wk = 0.0092593 + k( 17) = ( 0.6666667 0.3333333 0.0000000), wk = 0.0092593 + k( 18) = ( 0.8333333 0.3333333 0.0000000), wk = 0.0092593 + k( 19) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0092593 + k( 20) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0092593 + k( 21) = ( 0.3333333 0.5000000 0.0000000), wk = 0.0092593 + k( 22) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0092593 + k( 23) = ( 0.6666667 0.5000000 0.0000000), wk = 0.0092593 + k( 24) = ( 0.8333333 0.5000000 0.0000000), wk = 0.0092593 + k( 25) = ( 0.0000000 0.6666667 0.0000000), wk = 0.0092593 + k( 26) = ( 0.1666667 0.6666667 0.0000000), wk = 0.0092593 + k( 27) = ( 0.3333333 0.6666667 0.0000000), wk = 0.0092593 + k( 28) = ( 0.5000000 0.6666667 0.0000000), wk = 0.0092593 + k( 29) = ( 0.6666667 0.6666667 0.0000000), wk = 0.0092593 + k( 30) = ( 0.8333333 0.6666667 0.0000000), wk = 0.0092593 + k( 31) = ( 0.0000000 0.8333333 0.0000000), wk = 0.0092593 + k( 32) = ( 0.1666667 0.8333333 0.0000000), wk = 0.0092593 + k( 33) = ( 0.3333333 0.8333333 0.0000000), wk = 0.0092593 + k( 34) = ( 0.5000000 0.8333333 0.0000000), wk = 0.0092593 + k( 35) = ( 0.6666667 0.8333333 0.0000000), wk = 0.0092593 + k( 36) = ( 0.8333333 0.8333333 0.0000000), wk = 0.0092593 + k( 37) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0092593 + k( 38) = ( 0.1666667 0.0000000 0.1666667), wk = 0.0092593 + k( 39) = ( 0.3333333 0.0000000 0.1666667), wk = 0.0092593 + k( 40) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0092593 + k( 41) = ( 0.6666667 0.0000000 0.1666667), wk = 0.0092593 + k( 42) = ( 0.8333333 0.0000000 0.1666667), wk = 0.0092593 + k( 43) = ( 0.0000000 0.1666667 0.1666667), wk = 0.0092593 + k( 44) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0092593 + k( 45) = ( 0.3333333 0.1666667 0.1666667), wk = 0.0092593 + k( 46) = ( 0.5000000 0.1666667 0.1666667), wk = 0.0092593 + k( 47) = ( 0.6666667 0.1666667 0.1666667), wk = 0.0092593 + k( 48) = ( 0.8333333 0.1666667 0.1666667), wk = 0.0092593 + k( 49) = ( 0.0000000 0.3333333 0.1666667), wk = 0.0092593 + k( 50) = ( 0.1666667 0.3333333 0.1666667), wk = 0.0092593 + k( 51) = ( 0.3333333 0.3333333 0.1666667), wk = 0.0092593 + k( 52) = ( 0.5000000 0.3333333 0.1666667), wk = 0.0092593 + k( 53) = ( 0.6666667 0.3333333 0.1666667), wk = 0.0092593 + k( 54) = ( 0.8333333 0.3333333 0.1666667), wk = 0.0092593 + k( 55) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0092593 + k( 56) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0092593 + k( 57) = ( 0.3333333 0.5000000 0.1666667), wk = 0.0092593 + k( 58) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0092593 + k( 59) = ( 0.6666667 0.5000000 0.1666667), wk = 0.0092593 + k( 60) = ( 0.8333333 0.5000000 0.1666667), wk = 0.0092593 + k( 61) = ( 0.0000000 0.6666667 0.1666667), wk = 0.0092593 + k( 62) = ( 0.1666667 0.6666667 0.1666667), wk = 0.0092593 + k( 63) = ( 0.3333333 0.6666667 0.1666667), wk = 0.0092593 + k( 64) = ( 0.5000000 0.6666667 0.1666667), wk = 0.0092593 + k( 65) = ( 0.6666667 0.6666667 0.1666667), wk = 0.0092593 + k( 66) = ( 0.8333333 0.6666667 0.1666667), wk = 0.0092593 + k( 67) = ( 0.0000000 0.8333333 0.1666667), wk = 0.0092593 + k( 68) = ( 0.1666667 0.8333333 0.1666667), wk = 0.0092593 + k( 69) = ( 0.3333333 0.8333333 0.1666667), wk = 0.0092593 + k( 70) = ( 0.5000000 0.8333333 0.1666667), wk = 0.0092593 + k( 71) = ( 0.6666667 0.8333333 0.1666667), wk = 0.0092593 + k( 72) = ( 0.8333333 0.8333333 0.1666667), wk = 0.0092593 + k( 73) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0092593 + k( 74) = ( 0.1666667 0.0000000 0.3333333), wk = 0.0092593 + k( 75) = ( 0.3333333 0.0000000 0.3333333), wk = 0.0092593 + k( 76) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0092593 + k( 77) = ( 0.6666667 0.0000000 0.3333333), wk = 0.0092593 + k( 78) = ( 0.8333333 0.0000000 0.3333333), wk = 0.0092593 + k( 79) = ( 0.0000000 0.1666667 0.3333333), wk = 0.0092593 + k( 80) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0092593 + k( 81) = ( 0.3333333 0.1666667 0.3333333), wk = 0.0092593 + k( 82) = ( 0.5000000 0.1666667 0.3333333), wk = 0.0092593 + k( 83) = ( 0.6666667 0.1666667 0.3333333), wk = 0.0092593 + k( 84) = ( 0.8333333 0.1666667 0.3333333), wk = 0.0092593 + k( 85) = ( 0.0000000 0.3333333 0.3333333), wk = 0.0092593 + k( 86) = ( 0.1666667 0.3333333 0.3333333), wk = 0.0092593 + k( 87) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0092593 + k( 88) = ( 0.5000000 0.3333333 0.3333333), wk = 0.0092593 + k( 89) = ( 0.6666667 0.3333333 0.3333333), wk = 0.0092593 + k( 90) = ( 0.8333333 0.3333333 0.3333333), wk = 0.0092593 + k( 91) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0092593 + k( 92) = ( 0.1666667 0.5000000 0.3333333), wk = 0.0092593 + k( 93) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0092593 + k( 94) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0092593 + k( 95) = ( 0.6666667 0.5000000 0.3333333), wk = 0.0092593 + k( 96) = ( 0.8333333 0.5000000 0.3333333), wk = 0.0092593 + k( 97) = ( 0.0000000 0.6666667 0.3333333), wk = 0.0092593 + k( 98) = ( 0.1666667 0.6666667 0.3333333), wk = 0.0092593 + k( 99) = ( 0.3333333 0.6666667 0.3333333), wk = 0.0092593 + k( 100) = ( 0.5000000 0.6666667 0.3333333), wk = 0.0092593 + k( 101) = ( 0.6666667 0.6666667 0.3333333), wk = 0.0092593 + k( 102) = ( 0.8333333 0.6666667 0.3333333), wk = 0.0092593 + k( 103) = ( 0.0000000 0.8333333 0.3333333), wk = 0.0092593 + k( 104) = ( 0.1666667 0.8333333 0.3333333), wk = 0.0092593 + k( 105) = ( 0.3333333 0.8333333 0.3333333), wk = 0.0092593 + k( 106) = ( 0.5000000 0.8333333 0.3333333), wk = 0.0092593 + k( 107) = ( 0.6666667 0.8333333 0.3333333), wk = 0.0092593 + k( 108) = ( 0.8333333 0.8333333 0.3333333), wk = 0.0092593 + k( 109) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0092593 + k( 110) = ( 0.1666667 0.0000000 0.5000000), wk = 0.0092593 + k( 111) = ( 0.3333333 0.0000000 0.5000000), wk = 0.0092593 + k( 112) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0092593 + k( 113) = ( 0.6666667 0.0000000 0.5000000), wk = 0.0092593 + k( 114) = ( 0.8333333 0.0000000 0.5000000), wk = 0.0092593 + k( 115) = ( 0.0000000 0.1666667 0.5000000), wk = 0.0092593 + k( 116) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0092593 + k( 117) = ( 0.3333333 0.1666667 0.5000000), wk = 0.0092593 + k( 118) = ( 0.5000000 0.1666667 0.5000000), wk = 0.0092593 + k( 119) = ( 0.6666667 0.1666667 0.5000000), wk = 0.0092593 + k( 120) = ( 0.8333333 0.1666667 0.5000000), wk = 0.0092593 + k( 121) = ( 0.0000000 0.3333333 0.5000000), wk = 0.0092593 + k( 122) = ( 0.1666667 0.3333333 0.5000000), wk = 0.0092593 + k( 123) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0092593 + k( 124) = ( 0.5000000 0.3333333 0.5000000), wk = 0.0092593 + k( 125) = ( 0.6666667 0.3333333 0.5000000), wk = 0.0092593 + k( 126) = ( 0.8333333 0.3333333 0.5000000), wk = 0.0092593 + k( 127) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0092593 + k( 128) = ( 0.1666667 0.5000000 0.5000000), wk = 0.0092593 + k( 129) = ( 0.3333333 0.5000000 0.5000000), wk = 0.0092593 + k( 130) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0092593 + k( 131) = ( 0.6666667 0.5000000 0.5000000), wk = 0.0092593 + k( 132) = ( 0.8333333 0.5000000 0.5000000), wk = 0.0092593 + k( 133) = ( 0.0000000 0.6666667 0.5000000), wk = 0.0092593 + k( 134) = ( 0.1666667 0.6666667 0.5000000), wk = 0.0092593 + k( 135) = ( 0.3333333 0.6666667 0.5000000), wk = 0.0092593 + k( 136) = ( 0.5000000 0.6666667 0.5000000), wk = 0.0092593 + k( 137) = ( 0.6666667 0.6666667 0.5000000), wk = 0.0092593 + k( 138) = ( 0.8333333 0.6666667 0.5000000), wk = 0.0092593 + k( 139) = ( 0.0000000 0.8333333 0.5000000), wk = 0.0092593 + k( 140) = ( 0.1666667 0.8333333 0.5000000), wk = 0.0092593 + k( 141) = ( 0.3333333 0.8333333 0.5000000), wk = 0.0092593 + k( 142) = ( 0.5000000 0.8333333 0.5000000), wk = 0.0092593 + k( 143) = ( 0.6666667 0.8333333 0.5000000), wk = 0.0092593 + k( 144) = ( 0.8333333 0.8333333 0.5000000), wk = 0.0092593 + k( 145) = ( 0.0000000 0.0000000 0.6666667), wk = 0.0092593 + k( 146) = ( 0.1666667 0.0000000 0.6666667), wk = 0.0092593 + k( 147) = ( 0.3333333 0.0000000 0.6666667), wk = 0.0092593 + k( 148) = ( 0.5000000 0.0000000 0.6666667), wk = 0.0092593 + k( 149) = ( 0.6666667 0.0000000 0.6666667), wk = 0.0092593 + k( 150) = ( 0.8333333 0.0000000 0.6666667), wk = 0.0092593 + k( 151) = ( 0.0000000 0.1666667 0.6666667), wk = 0.0092593 + k( 152) = ( 0.1666667 0.1666667 0.6666667), wk = 0.0092593 + k( 153) = ( 0.3333333 0.1666667 0.6666667), wk = 0.0092593 + k( 154) = ( 0.5000000 0.1666667 0.6666667), wk = 0.0092593 + k( 155) = ( 0.6666667 0.1666667 0.6666667), wk = 0.0092593 + k( 156) = ( 0.8333333 0.1666667 0.6666667), wk = 0.0092593 + k( 157) = ( 0.0000000 0.3333333 0.6666667), wk = 0.0092593 + k( 158) = ( 0.1666667 0.3333333 0.6666667), wk = 0.0092593 + k( 159) = ( 0.3333333 0.3333333 0.6666667), wk = 0.0092593 + k( 160) = ( 0.5000000 0.3333333 0.6666667), wk = 0.0092593 + k( 161) = ( 0.6666667 0.3333333 0.6666667), wk = 0.0092593 + k( 162) = ( 0.8333333 0.3333333 0.6666667), wk = 0.0092593 + k( 163) = ( 0.0000000 0.5000000 0.6666667), wk = 0.0092593 + k( 164) = ( 0.1666667 0.5000000 0.6666667), wk = 0.0092593 + k( 165) = ( 0.3333333 0.5000000 0.6666667), wk = 0.0092593 + k( 166) = ( 0.5000000 0.5000000 0.6666667), wk = 0.0092593 + k( 167) = ( 0.6666667 0.5000000 0.6666667), wk = 0.0092593 + k( 168) = ( 0.8333333 0.5000000 0.6666667), wk = 0.0092593 + k( 169) = ( 0.0000000 0.6666667 0.6666667), wk = 0.0092593 + k( 170) = ( 0.1666667 0.6666667 0.6666667), wk = 0.0092593 + k( 171) = ( 0.3333333 0.6666667 0.6666667), wk = 0.0092593 + k( 172) = ( 0.5000000 0.6666667 0.6666667), wk = 0.0092593 + k( 173) = ( 0.6666667 0.6666667 0.6666667), wk = 0.0092593 + k( 174) = ( 0.8333333 0.6666667 0.6666667), wk = 0.0092593 + k( 175) = ( 0.0000000 0.8333333 0.6666667), wk = 0.0092593 + k( 176) = ( 0.1666667 0.8333333 0.6666667), wk = 0.0092593 + k( 177) = ( 0.3333333 0.8333333 0.6666667), wk = 0.0092593 + k( 178) = ( 0.5000000 0.8333333 0.6666667), wk = 0.0092593 + k( 179) = ( 0.6666667 0.8333333 0.6666667), wk = 0.0092593 + k( 180) = ( 0.8333333 0.8333333 0.6666667), wk = 0.0092593 + k( 181) = ( 0.0000000 0.0000000 0.8333333), wk = 0.0092593 + k( 182) = ( 0.1666667 0.0000000 0.8333333), wk = 0.0092593 + k( 183) = ( 0.3333333 0.0000000 0.8333333), wk = 0.0092593 + k( 184) = ( 0.5000000 0.0000000 0.8333333), wk = 0.0092593 + k( 185) = ( 0.6666667 0.0000000 0.8333333), wk = 0.0092593 + k( 186) = ( 0.8333333 0.0000000 0.8333333), wk = 0.0092593 + k( 187) = ( 0.0000000 0.1666667 0.8333333), wk = 0.0092593 + k( 188) = ( 0.1666667 0.1666667 0.8333333), wk = 0.0092593 + k( 189) = ( 0.3333333 0.1666667 0.8333333), wk = 0.0092593 + k( 190) = ( 0.5000000 0.1666667 0.8333333), wk = 0.0092593 + k( 191) = ( 0.6666667 0.1666667 0.8333333), wk = 0.0092593 + k( 192) = ( 0.8333333 0.1666667 0.8333333), wk = 0.0092593 + k( 193) = ( 0.0000000 0.3333333 0.8333333), wk = 0.0092593 + k( 194) = ( 0.1666667 0.3333333 0.8333333), wk = 0.0092593 + k( 195) = ( 0.3333333 0.3333333 0.8333333), wk = 0.0092593 + k( 196) = ( 0.5000000 0.3333333 0.8333333), wk = 0.0092593 + k( 197) = ( 0.6666667 0.3333333 0.8333333), wk = 0.0092593 + k( 198) = ( 0.8333333 0.3333333 0.8333333), wk = 0.0092593 + k( 199) = ( 0.0000000 0.5000000 0.8333333), wk = 0.0092593 + k( 200) = ( 0.1666667 0.5000000 0.8333333), wk = 0.0092593 + k( 201) = ( 0.3333333 0.5000000 0.8333333), wk = 0.0092593 + k( 202) = ( 0.5000000 0.5000000 0.8333333), wk = 0.0092593 + k( 203) = ( 0.6666667 0.5000000 0.8333333), wk = 0.0092593 + k( 204) = ( 0.8333333 0.5000000 0.8333333), wk = 0.0092593 + k( 205) = ( 0.0000000 0.6666667 0.8333333), wk = 0.0092593 + k( 206) = ( 0.1666667 0.6666667 0.8333333), wk = 0.0092593 + k( 207) = ( 0.3333333 0.6666667 0.8333333), wk = 0.0092593 + k( 208) = ( 0.5000000 0.6666667 0.8333333), wk = 0.0092593 + k( 209) = ( 0.6666667 0.6666667 0.8333333), wk = 0.0092593 + k( 210) = ( 0.8333333 0.6666667 0.8333333), wk = 0.0092593 + k( 211) = ( 0.0000000 0.8333333 0.8333333), wk = 0.0092593 + k( 212) = ( 0.1666667 0.8333333 0.8333333), wk = 0.0092593 + k( 213) = ( 0.3333333 0.8333333 0.8333333), wk = 0.0092593 + k( 214) = ( 0.5000000 0.8333333 0.8333333), wk = 0.0092593 + k( 215) = ( 0.6666667 0.8333333 0.8333333), wk = 0.0092593 + k( 216) = ( 0.8333333 0.8333333 0.8333333), wk = 0.0092593 + + cryst. coord. + k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0092593 + k( 2) = ( 0.1666667 0.0000000 0.0000000), wk = 0.0092593 + k( 3) = ( 0.3333333 0.0000000 0.0000000), wk = 0.0092593 + k( 4) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0092593 + k( 5) = ( 0.6666667 0.0000000 0.0000000), wk = 0.0092593 + k( 6) = ( 0.8333333 0.0000000 0.0000000), wk = 0.0092593 + k( 7) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0092593 + k( 8) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0092593 + k( 9) = ( 0.3333333 0.1666667 0.0000000), wk = 0.0092593 + k( 10) = ( 0.5000000 0.1666667 0.0000000), wk = 0.0092593 + k( 11) = ( 0.6666667 0.1666667 0.0000000), wk = 0.0092593 + k( 12) = ( 0.8333333 0.1666667 0.0000000), wk = 0.0092593 + k( 13) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0092593 + k( 14) = ( 0.1666667 0.3333333 0.0000000), wk = 0.0092593 + k( 15) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0092593 + k( 16) = ( 0.5000000 0.3333333 0.0000000), wk = 0.0092593 + k( 17) = ( 0.6666667 0.3333333 0.0000000), wk = 0.0092593 + k( 18) = ( 0.8333333 0.3333333 0.0000000), wk = 0.0092593 + k( 19) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0092593 + k( 20) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0092593 + k( 21) = ( 0.3333333 0.5000000 0.0000000), wk = 0.0092593 + k( 22) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0092593 + k( 23) = ( 0.6666667 0.5000000 0.0000000), wk = 0.0092593 + k( 24) = ( 0.8333333 0.5000000 0.0000000), wk = 0.0092593 + k( 25) = ( 0.0000000 0.6666667 0.0000000), wk = 0.0092593 + k( 26) = ( 0.1666667 0.6666667 0.0000000), wk = 0.0092593 + k( 27) = ( 0.3333333 0.6666667 0.0000000), wk = 0.0092593 + k( 28) = ( 0.5000000 0.6666667 0.0000000), wk = 0.0092593 + k( 29) = ( 0.6666667 0.6666667 0.0000000), wk = 0.0092593 + k( 30) = ( 0.8333333 0.6666667 0.0000000), wk = 0.0092593 + k( 31) = ( 0.0000000 0.8333333 0.0000000), wk = 0.0092593 + k( 32) = ( 0.1666667 0.8333333 0.0000000), wk = 0.0092593 + k( 33) = ( 0.3333333 0.8333333 0.0000000), wk = 0.0092593 + k( 34) = ( 0.5000000 0.8333333 0.0000000), wk = 0.0092593 + k( 35) = ( 0.6666667 0.8333333 0.0000000), wk = 0.0092593 + k( 36) = ( 0.8333333 0.8333333 0.0000000), wk = 0.0092593 + k( 37) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0092593 + k( 38) = ( 0.1666667 0.0000000 0.1666667), wk = 0.0092593 + k( 39) = ( 0.3333333 0.0000000 0.1666667), wk = 0.0092593 + k( 40) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0092593 + k( 41) = ( 0.6666667 0.0000000 0.1666667), wk = 0.0092593 + k( 42) = ( 0.8333333 0.0000000 0.1666667), wk = 0.0092593 + k( 43) = ( 0.0000000 0.1666667 0.1666667), wk = 0.0092593 + k( 44) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0092593 + k( 45) = ( 0.3333333 0.1666667 0.1666667), wk = 0.0092593 + k( 46) = ( 0.5000000 0.1666667 0.1666667), wk = 0.0092593 + k( 47) = ( 0.6666667 0.1666667 0.1666667), wk = 0.0092593 + k( 48) = ( 0.8333333 0.1666667 0.1666667), wk = 0.0092593 + k( 49) = ( 0.0000000 0.3333333 0.1666667), wk = 0.0092593 + k( 50) = ( 0.1666667 0.3333333 0.1666667), wk = 0.0092593 + k( 51) = ( 0.3333333 0.3333333 0.1666667), wk = 0.0092593 + k( 52) = ( 0.5000000 0.3333333 0.1666667), wk = 0.0092593 + k( 53) = ( 0.6666667 0.3333333 0.1666667), wk = 0.0092593 + k( 54) = ( 0.8333333 0.3333333 0.1666667), wk = 0.0092593 + k( 55) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0092593 + k( 56) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0092593 + k( 57) = ( 0.3333333 0.5000000 0.1666667), wk = 0.0092593 + k( 58) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0092593 + k( 59) = ( 0.6666667 0.5000000 0.1666667), wk = 0.0092593 + k( 60) = ( 0.8333333 0.5000000 0.1666667), wk = 0.0092593 + k( 61) = ( 0.0000000 0.6666667 0.1666667), wk = 0.0092593 + k( 62) = ( 0.1666667 0.6666667 0.1666667), wk = 0.0092593 + k( 63) = ( 0.3333333 0.6666667 0.1666667), wk = 0.0092593 + k( 64) = ( 0.5000000 0.6666667 0.1666667), wk = 0.0092593 + k( 65) = ( 0.6666667 0.6666667 0.1666667), wk = 0.0092593 + k( 66) = ( 0.8333333 0.6666667 0.1666667), wk = 0.0092593 + k( 67) = ( 0.0000000 0.8333333 0.1666667), wk = 0.0092593 + k( 68) = ( 0.1666667 0.8333333 0.1666667), wk = 0.0092593 + k( 69) = ( 0.3333333 0.8333333 0.1666667), wk = 0.0092593 + k( 70) = ( 0.5000000 0.8333333 0.1666667), wk = 0.0092593 + k( 71) = ( 0.6666667 0.8333333 0.1666667), wk = 0.0092593 + k( 72) = ( 0.8333333 0.8333333 0.1666667), wk = 0.0092593 + k( 73) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0092593 + k( 74) = ( 0.1666667 0.0000000 0.3333333), wk = 0.0092593 + k( 75) = ( 0.3333333 0.0000000 0.3333333), wk = 0.0092593 + k( 76) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0092593 + k( 77) = ( 0.6666667 0.0000000 0.3333333), wk = 0.0092593 + k( 78) = ( 0.8333333 0.0000000 0.3333333), wk = 0.0092593 + k( 79) = ( 0.0000000 0.1666667 0.3333333), wk = 0.0092593 + k( 80) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0092593 + k( 81) = ( 0.3333333 0.1666667 0.3333333), wk = 0.0092593 + k( 82) = ( 0.5000000 0.1666667 0.3333333), wk = 0.0092593 + k( 83) = ( 0.6666667 0.1666667 0.3333333), wk = 0.0092593 + k( 84) = ( 0.8333333 0.1666667 0.3333333), wk = 0.0092593 + k( 85) = ( 0.0000000 0.3333333 0.3333333), wk = 0.0092593 + k( 86) = ( 0.1666667 0.3333333 0.3333333), wk = 0.0092593 + k( 87) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0092593 + k( 88) = ( 0.5000000 0.3333333 0.3333333), wk = 0.0092593 + k( 89) = ( 0.6666667 0.3333333 0.3333333), wk = 0.0092593 + k( 90) = ( 0.8333333 0.3333333 0.3333333), wk = 0.0092593 + k( 91) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0092593 + k( 92) = ( 0.1666667 0.5000000 0.3333333), wk = 0.0092593 + k( 93) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0092593 + k( 94) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0092593 + k( 95) = ( 0.6666667 0.5000000 0.3333333), wk = 0.0092593 + k( 96) = ( 0.8333333 0.5000000 0.3333333), wk = 0.0092593 + k( 97) = ( 0.0000000 0.6666667 0.3333333), wk = 0.0092593 + k( 98) = ( 0.1666667 0.6666667 0.3333333), wk = 0.0092593 + k( 99) = ( 0.3333333 0.6666667 0.3333333), wk = 0.0092593 + k( 100) = ( 0.5000000 0.6666667 0.3333333), wk = 0.0092593 + k( 101) = ( 0.6666667 0.6666667 0.3333333), wk = 0.0092593 + k( 102) = ( 0.8333333 0.6666667 0.3333333), wk = 0.0092593 + k( 103) = ( 0.0000000 0.8333333 0.3333333), wk = 0.0092593 + k( 104) = ( 0.1666667 0.8333333 0.3333333), wk = 0.0092593 + k( 105) = ( 0.3333333 0.8333333 0.3333333), wk = 0.0092593 + k( 106) = ( 0.5000000 0.8333333 0.3333333), wk = 0.0092593 + k( 107) = ( 0.6666667 0.8333333 0.3333333), wk = 0.0092593 + k( 108) = ( 0.8333333 0.8333333 0.3333333), wk = 0.0092593 + k( 109) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0092593 + k( 110) = ( 0.1666667 0.0000000 0.5000000), wk = 0.0092593 + k( 111) = ( 0.3333333 0.0000000 0.5000000), wk = 0.0092593 + k( 112) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0092593 + k( 113) = ( 0.6666667 0.0000000 0.5000000), wk = 0.0092593 + k( 114) = ( 0.8333333 0.0000000 0.5000000), wk = 0.0092593 + k( 115) = ( 0.0000000 0.1666667 0.5000000), wk = 0.0092593 + k( 116) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0092593 + k( 117) = ( 0.3333333 0.1666667 0.5000000), wk = 0.0092593 + k( 118) = ( 0.5000000 0.1666667 0.5000000), wk = 0.0092593 + k( 119) = ( 0.6666667 0.1666667 0.5000000), wk = 0.0092593 + k( 120) = ( 0.8333333 0.1666667 0.5000000), wk = 0.0092593 + k( 121) = ( 0.0000000 0.3333333 0.5000000), wk = 0.0092593 + k( 122) = ( 0.1666667 0.3333333 0.5000000), wk = 0.0092593 + k( 123) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0092593 + k( 124) = ( 0.5000000 0.3333333 0.5000000), wk = 0.0092593 + k( 125) = ( 0.6666667 0.3333333 0.5000000), wk = 0.0092593 + k( 126) = ( 0.8333333 0.3333333 0.5000000), wk = 0.0092593 + k( 127) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0092593 + k( 128) = ( 0.1666667 0.5000000 0.5000000), wk = 0.0092593 + k( 129) = ( 0.3333333 0.5000000 0.5000000), wk = 0.0092593 + k( 130) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0092593 + k( 131) = ( 0.6666667 0.5000000 0.5000000), wk = 0.0092593 + k( 132) = ( 0.8333333 0.5000000 0.5000000), wk = 0.0092593 + k( 133) = ( 0.0000000 0.6666667 0.5000000), wk = 0.0092593 + k( 134) = ( 0.1666667 0.6666667 0.5000000), wk = 0.0092593 + k( 135) = ( 0.3333333 0.6666667 0.5000000), wk = 0.0092593 + k( 136) = ( 0.5000000 0.6666667 0.5000000), wk = 0.0092593 + k( 137) = ( 0.6666667 0.6666667 0.5000000), wk = 0.0092593 + k( 138) = ( 0.8333333 0.6666667 0.5000000), wk = 0.0092593 + k( 139) = ( 0.0000000 0.8333333 0.5000000), wk = 0.0092593 + k( 140) = ( 0.1666667 0.8333333 0.5000000), wk = 0.0092593 + k( 141) = ( 0.3333333 0.8333333 0.5000000), wk = 0.0092593 + k( 142) = ( 0.5000000 0.8333333 0.5000000), wk = 0.0092593 + k( 143) = ( 0.6666667 0.8333333 0.5000000), wk = 0.0092593 + k( 144) = ( 0.8333333 0.8333333 0.5000000), wk = 0.0092593 + k( 145) = ( 0.0000000 0.0000000 0.6666667), wk = 0.0092593 + k( 146) = ( 0.1666667 0.0000000 0.6666667), wk = 0.0092593 + k( 147) = ( 0.3333333 0.0000000 0.6666667), wk = 0.0092593 + k( 148) = ( 0.5000000 0.0000000 0.6666667), wk = 0.0092593 + k( 149) = ( 0.6666667 0.0000000 0.6666667), wk = 0.0092593 + k( 150) = ( 0.8333333 0.0000000 0.6666667), wk = 0.0092593 + k( 151) = ( 0.0000000 0.1666667 0.6666667), wk = 0.0092593 + k( 152) = ( 0.1666667 0.1666667 0.6666667), wk = 0.0092593 + k( 153) = ( 0.3333333 0.1666667 0.6666667), wk = 0.0092593 + k( 154) = ( 0.5000000 0.1666667 0.6666667), wk = 0.0092593 + k( 155) = ( 0.6666667 0.1666667 0.6666667), wk = 0.0092593 + k( 156) = ( 0.8333333 0.1666667 0.6666667), wk = 0.0092593 + k( 157) = ( 0.0000000 0.3333333 0.6666667), wk = 0.0092593 + k( 158) = ( 0.1666667 0.3333333 0.6666667), wk = 0.0092593 + k( 159) = ( 0.3333333 0.3333333 0.6666667), wk = 0.0092593 + k( 160) = ( 0.5000000 0.3333333 0.6666667), wk = 0.0092593 + k( 161) = ( 0.6666667 0.3333333 0.6666667), wk = 0.0092593 + k( 162) = ( 0.8333333 0.3333333 0.6666667), wk = 0.0092593 + k( 163) = ( 0.0000000 0.5000000 0.6666667), wk = 0.0092593 + k( 164) = ( 0.1666667 0.5000000 0.6666667), wk = 0.0092593 + k( 165) = ( 0.3333333 0.5000000 0.6666667), wk = 0.0092593 + k( 166) = ( 0.5000000 0.5000000 0.6666667), wk = 0.0092593 + k( 167) = ( 0.6666667 0.5000000 0.6666667), wk = 0.0092593 + k( 168) = ( 0.8333333 0.5000000 0.6666667), wk = 0.0092593 + k( 169) = ( 0.0000000 0.6666667 0.6666667), wk = 0.0092593 + k( 170) = ( 0.1666667 0.6666667 0.6666667), wk = 0.0092593 + k( 171) = ( 0.3333333 0.6666667 0.6666667), wk = 0.0092593 + k( 172) = ( 0.5000000 0.6666667 0.6666667), wk = 0.0092593 + k( 173) = ( 0.6666667 0.6666667 0.6666667), wk = 0.0092593 + k( 174) = ( 0.8333333 0.6666667 0.6666667), wk = 0.0092593 + k( 175) = ( 0.0000000 0.8333333 0.6666667), wk = 0.0092593 + k( 176) = ( 0.1666667 0.8333333 0.6666667), wk = 0.0092593 + k( 177) = ( 0.3333333 0.8333333 0.6666667), wk = 0.0092593 + k( 178) = ( 0.5000000 0.8333333 0.6666667), wk = 0.0092593 + k( 179) = ( 0.6666667 0.8333333 0.6666667), wk = 0.0092593 + k( 180) = ( 0.8333333 0.8333333 0.6666667), wk = 0.0092593 + k( 181) = ( 0.0000000 0.0000000 0.8333333), wk = 0.0092593 + k( 182) = ( 0.1666667 0.0000000 0.8333333), wk = 0.0092593 + k( 183) = ( 0.3333333 0.0000000 0.8333333), wk = 0.0092593 + k( 184) = ( 0.5000000 0.0000000 0.8333333), wk = 0.0092593 + k( 185) = ( 0.6666667 0.0000000 0.8333333), wk = 0.0092593 + k( 186) = ( 0.8333333 0.0000000 0.8333333), wk = 0.0092593 + k( 187) = ( 0.0000000 0.1666667 0.8333333), wk = 0.0092593 + k( 188) = ( 0.1666667 0.1666667 0.8333333), wk = 0.0092593 + k( 189) = ( 0.3333333 0.1666667 0.8333333), wk = 0.0092593 + k( 190) = ( 0.5000000 0.1666667 0.8333333), wk = 0.0092593 + k( 191) = ( 0.6666667 0.1666667 0.8333333), wk = 0.0092593 + k( 192) = ( 0.8333333 0.1666667 0.8333333), wk = 0.0092593 + k( 193) = ( 0.0000000 0.3333333 0.8333333), wk = 0.0092593 + k( 194) = ( 0.1666667 0.3333333 0.8333333), wk = 0.0092593 + k( 195) = ( 0.3333333 0.3333333 0.8333333), wk = 0.0092593 + k( 196) = ( 0.5000000 0.3333333 0.8333333), wk = 0.0092593 + k( 197) = ( 0.6666667 0.3333333 0.8333333), wk = 0.0092593 + k( 198) = ( 0.8333333 0.3333333 0.8333333), wk = 0.0092593 + k( 199) = ( 0.0000000 0.5000000 0.8333333), wk = 0.0092593 + k( 200) = ( 0.1666667 0.5000000 0.8333333), wk = 0.0092593 + k( 201) = ( 0.3333333 0.5000000 0.8333333), wk = 0.0092593 + k( 202) = ( 0.5000000 0.5000000 0.8333333), wk = 0.0092593 + k( 203) = ( 0.6666667 0.5000000 0.8333333), wk = 0.0092593 + k( 204) = ( 0.8333333 0.5000000 0.8333333), wk = 0.0092593 + k( 205) = ( 0.0000000 0.6666667 0.8333333), wk = 0.0092593 + k( 206) = ( 0.1666667 0.6666667 0.8333333), wk = 0.0092593 + k( 207) = ( 0.3333333 0.6666667 0.8333333), wk = 0.0092593 + k( 208) = ( 0.5000000 0.6666667 0.8333333), wk = 0.0092593 + k( 209) = ( 0.6666667 0.6666667 0.8333333), wk = 0.0092593 + k( 210) = ( 0.8333333 0.6666667 0.8333333), wk = 0.0092593 + k( 211) = ( 0.0000000 0.8333333 0.8333333), wk = 0.0092593 + k( 212) = ( 0.1666667 0.8333333 0.8333333), wk = 0.0092593 + k( 213) = ( 0.3333333 0.8333333 0.8333333), wk = 0.0092593 + k( 214) = ( 0.5000000 0.8333333 0.8333333), wk = 0.0092593 + k( 215) = ( 0.6666667 0.8333333 0.8333333), wk = 0.0092593 + k( 216) = ( 0.8333333 0.8333333 0.8333333), wk = 0.0092593 + + Dense grid: 13133 G-vectors FFT dimensions: ( 30, 30, 30) + + Dynamical RAM for wfc: 0.40 MB + + Dynamical RAM for wfc (w. buffer): 0.40 MB + + Dynamical RAM for str. fact: 0.20 MB + + Dynamical RAM for local pot: 0.00 MB + + Dynamical RAM for nlocal pot: 1.59 MB + + Dynamical RAM for qrad: 0.21 MB + + Dynamical RAM for rho,v,vnew: 1.22 MB + + Dynamical RAM for G-vectors: 0.85 MB + + Dynamical RAM for h,s,v(r/c): 0.05 MB + + Dynamical RAM for : 0.02 MB + + Dynamical RAM for psi: 0.80 MB + + Dynamical RAM for hpsi: 0.80 MB + + Dynamical RAM for spsi: 0.80 MB + + Dynamical RAM for wfcinit/wfcrot: 1.62 MB + + Dynamical RAM for addusdens: 2.71 MB + + Estimated static dynamical RAM per process > 5.90 MB + + Estimated max dynamical RAM per process > 8.61 MB + + Estimated total dynamical RAM > 34.42 MB + + Check: negative core charge= -0.000010 + + The potential is recalculated from file : + /home/ponet/.julia/dev/DFControl/docs/build/guide/Job2/outputs/Si.save/charge-density + + Starting wfcs are 32 randomized atomic wfcs + Checking if some PAW data can be deallocated... + + Band Structure Calculation + Davidson diagonalization with overlap + + Computing kpt #: 1 of 54 on this pool + total cpu time spent up to now is 0.6 secs + + Computing kpt #: 2 of 54 on this pool + total cpu time spent up to now is 0.8 secs + + Computing kpt #: 3 of 54 on this pool + total cpu time spent up to now is 1.0 secs + + Computing kpt #: 4 of 54 on this pool + total cpu time spent up to now is 1.2 secs + + Computing kpt #: 5 of 54 on this pool + total cpu time spent up to now is 1.4 secs + + Computing kpt #: 6 of 54 on this pool + total cpu time spent up to now is 1.6 secs + + Computing kpt #: 7 of 54 on this pool + total cpu time spent up to now is 1.8 secs + + Computing kpt #: 8 of 54 on this pool + total cpu time spent up to now is 2.0 secs + + Computing kpt #: 9 of 54 on this pool + total cpu time spent up to now is 2.2 secs + + Computing kpt #: 10 of 54 on this pool + total cpu time spent up to now is 2.4 secs + + Computing kpt #: 11 of 54 on this pool + total cpu time spent up to now is 2.6 secs + + Computing kpt #: 12 of 54 on this pool + total cpu time spent up to now is 2.8 secs + + Computing kpt #: 13 of 54 on this pool + total cpu time spent up to now is 3.0 secs + + Computing kpt #: 14 of 54 on this pool + total cpu time spent up to now is 3.2 secs + + Computing kpt #: 15 of 54 on this pool + total cpu time spent up to now is 3.3 secs + + Computing kpt #: 16 of 54 on this pool + total cpu time spent up to now is 3.5 secs + + Computing kpt #: 17 of 54 on this pool + total cpu time spent up to now is 3.7 secs + + Computing kpt #: 18 of 54 on this pool + total cpu time spent up to now is 3.9 secs + + Computing kpt #: 19 of 54 on this pool + total cpu time spent up to now is 4.1 secs + + Computing kpt #: 20 of 54 on this pool + total cpu time spent up to now is 4.3 secs + + Computing kpt #: 21 of 54 on this pool + total cpu time spent up to now is 4.5 secs + + Computing kpt #: 22 of 54 on this pool + total cpu time spent up to now is 4.7 secs + + Computing kpt #: 23 of 54 on this pool + total cpu time spent up to now is 4.8 secs + + Computing kpt #: 24 of 54 on this pool + total cpu time spent up to now is 5.0 secs + + Computing kpt #: 25 of 54 on this pool + total cpu time spent up to now is 5.2 secs + + Computing kpt #: 26 of 54 on this pool + total cpu time spent up to now is 5.4 secs + + Computing kpt #: 27 of 54 on this pool + total cpu time spent up to now is 5.6 secs + + Computing kpt #: 28 of 54 on this pool + total cpu time spent up to now is 5.8 secs + + Computing kpt #: 29 of 54 on this pool + total cpu time spent up to now is 6.0 secs + + Computing kpt #: 30 of 54 on this pool + total cpu time spent up to now is 6.2 secs + + Computing kpt #: 31 of 54 on this pool + total cpu time spent up to now is 6.4 secs + + Computing kpt #: 32 of 54 on this pool + total cpu time spent up to now is 6.5 secs + + Computing kpt #: 33 of 54 on this pool + total cpu time spent up to now is 6.7 secs + + Computing kpt #: 34 of 54 on this pool + total cpu time spent up to now is 6.9 secs + + Computing kpt #: 35 of 54 on this pool + total cpu time spent up to now is 7.1 secs + + Computing kpt #: 36 of 54 on this pool + total cpu time spent up to now is 7.3 secs + + Computing kpt #: 37 of 54 on this pool + total cpu time spent up to now is 7.5 secs + + Computing kpt #: 38 of 54 on this pool + total cpu time spent up to now is 7.7 secs + + Computing kpt #: 39 of 54 on this pool + total cpu time spent up to now is 7.9 secs + + Computing kpt #: 40 of 54 on this pool + total cpu time spent up to now is 8.1 secs + + Computing kpt #: 41 of 54 on this pool + total cpu time spent up to now is 8.3 secs + + Computing kpt #: 42 of 54 on this pool + total cpu time spent up to now is 8.5 secs + + Computing kpt #: 43 of 54 on this pool + total cpu time spent up to now is 8.7 secs + + Computing kpt #: 44 of 54 on this pool + total cpu time spent up to now is 8.9 secs + + Computing kpt #: 45 of 54 on this pool + total cpu time spent up to now is 9.0 secs + + Computing kpt #: 46 of 54 on this pool + total cpu time spent up to now is 9.2 secs + + Computing kpt #: 47 of 54 on this pool + total cpu time spent up to now is 9.4 secs + + Computing kpt #: 48 of 54 on this pool + total cpu time spent up to now is 9.6 secs + + Computing kpt #: 49 of 54 on this pool + total cpu time spent up to now is 9.8 secs + + Computing kpt #: 50 of 54 on this pool + total cpu time spent up to now is 10.0 secs + + Computing kpt #: 51 of 54 on this pool + total cpu time spent up to now is 10.2 secs + + Computing kpt #: 52 of 54 on this pool + total cpu time spent up to now is 10.4 secs + + Computing kpt #: 53 of 54 on this pool + total cpu time spent up to now is 10.5 secs + + Computing kpt #: 54 of 54 on this pool + total cpu time spent up to now is 10.7 secs + + ethr = 3.12E-09, avg # of iterations = 25.8 + + total cpu time spent up to now is 10.7 secs + + End of band structure calculation + + k = 0.0000 0.0000 0.0000 ( 1647 PWs) bands (ev): + + -5.8294 -1.6690 -1.6690 -1.6690 -1.6689 -1.6689 -1.6668 3.2886 + 3.2886 3.2886 3.2893 3.2893 3.2893 6.1733 6.1733 6.1733 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.0000 0.0000 ( 1631 PWs) bands (ev): + + -5.7075 -2.8842 -1.6295 -1.6295 -1.6294 -1.6280 -0.3080 2.9706 + 2.9709 2.9709 2.9712 3.3993 3.3993 5.4728 5.7347 5.7347 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.0000 0.0000 ( 1630 PWs) bands (ev): + + -5.3435 -3.9178 -1.5447 -1.5447 -1.5446 -1.5431 1.1472 2.4708 + 2.4710 2.4710 2.4711 3.7263 3.7263 4.1244 4.9616 4.9616 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.0000 0.0000 ( 1654 PWs) bands (ev): + + -4.7439 -4.7429 -1.4990 -1.4990 -1.4989 -1.4974 2.2575 2.2576 + 2.2576 2.2577 2.6433 2.6436 4.2570 4.2570 4.2581 4.2581 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.0000 0.0000 ( 1630 PWs) bands (ev): + + -5.3435 -3.9178 -1.5447 -1.5447 -1.5446 -1.5431 1.1472 2.4708 + 2.4710 2.4710 2.4711 3.7263 3.7263 4.1244 4.9616 4.9616 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.0000 0.0000 ( 1631 PWs) bands (ev): + + -5.7075 -2.8842 -1.6295 -1.6295 -1.6294 -1.6280 -0.3080 2.9706 + 2.9709 2.9709 2.9712 3.3993 3.3993 5.4728 5.7347 5.7347 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.1667 0.0000 ( 1631 PWs) bands (ev): + + -5.7075 -2.8842 -1.6295 -1.6295 -1.6294 -1.6280 -0.3080 2.9706 + 2.9709 2.9709 2.9712 3.3993 3.3993 5.4728 5.7347 5.7347 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.1667 0.0000 ( 1638 PWs) bands (ev): + + -5.5865 -2.8060 -2.8052 -1.8052 -1.4057 -0.3443 -0.3438 2.2676 + 3.0058 3.0059 3.2056 3.2063 3.4838 4.5682 5.2900 6.0549 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.1667 0.0000 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.1667 0.0000 ( 1634 PWs) bands (ev): + + -4.6327 -4.6317 -2.2929 -2.2920 -0.7668 -0.7663 1.8971 1.8973 + 2.2355 2.2357 3.0447 3.0448 3.8053 3.8057 4.5234 4.5236 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.1667 0.0000 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.1667 0.0000 ( 1638 PWs) bands (ev): + + -5.5865 -2.8060 -2.8052 -1.8052 -1.4057 -0.3443 -0.3438 2.2676 + 3.0058 3.0059 3.2056 3.2063 3.4838 4.5682 5.2900 6.0549 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.3333 0.0000 ( 1630 PWs) bands (ev): + + -5.3435 -3.9178 -1.5447 -1.5447 -1.5446 -1.5431 1.1472 2.4708 + 2.4710 2.4710 2.4711 3.7263 3.7263 4.1244 4.9616 4.9616 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.3333 0.0000 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.3333 0.0000 ( 1614 PWs) bands (ev): + + -4.8759 -3.5295 -3.5287 -2.5453 -0.6219 0.5095 0.5097 1.6905 + 2.4337 2.5475 2.5476 3.7172 3.8416 3.8426 4.0368 5.6034 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.3333 0.0000 ( 1622 PWs) bands (ev): + + -4.3043 -4.3032 -3.0834 -3.0824 -0.0673 -0.0670 1.4628 1.4629 + 1.9572 1.9575 3.0229 3.0232 4.0662 4.0664 4.8826 4.8828 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.3333 0.0000 ( 1614 PWs) bands (ev): + + -4.8759 -3.5295 -3.5287 -2.5453 -0.6219 0.5095 0.5097 1.6905 + 2.4337 2.5475 2.5476 3.7172 3.8416 3.8426 4.0368 5.6034 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.3333 0.0000 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.5000 0.0000 ( 1654 PWs) bands (ev): + + -4.7439 -4.7429 -1.4990 -1.4990 -1.4989 -1.4974 2.2575 2.2576 + 2.2576 2.2577 2.6433 2.6436 4.2570 4.2570 4.2581 4.2581 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.5000 0.0000 ( 1634 PWs) bands (ev): + + -4.6327 -4.6317 -2.2929 -2.2920 -0.7668 -0.7663 1.8971 1.8973 + 2.2355 2.2357 3.0447 3.0448 3.8053 3.8057 4.5234 4.5236 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.5000 0.0000 ( 1622 PWs) bands (ev): + + -4.3043 -4.3032 -3.0834 -3.0824 -0.0673 -0.0670 1.4628 1.4629 + 1.9572 1.9575 3.0229 3.0232 4.0662 4.0664 4.8826 4.8828 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.5000 0.0000 ( 1628 PWs) bands (ev): + + -3.7759 -3.7757 -3.7757 -3.7739 0.6684 0.6684 0.6685 0.6687 + 2.3603 2.3608 2.3608 2.3611 4.8292 4.8297 4.8305 4.8305 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.5000 0.0000 ( 1622 PWs) bands (ev): + + -4.3043 -4.3032 -3.0834 -3.0824 -0.0673 -0.0670 1.4628 1.4629 + 1.9572 1.9575 3.0229 3.0232 4.0662 4.0664 4.8826 4.8828 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.5000 0.0000 ( 1634 PWs) bands (ev): + + -4.6327 -4.6317 -2.2929 -2.2920 -0.7668 -0.7663 1.8971 1.8973 + 2.2355 2.2357 3.0447 3.0448 3.8053 3.8057 4.5234 4.5236 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.6667 0.0000 ( 1630 PWs) bands (ev): + + -5.3435 -3.9178 -1.5447 -1.5447 -1.5446 -1.5431 1.1472 2.4708 + 2.4710 2.4710 2.4711 3.7263 3.7263 4.1244 4.9616 4.9616 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.6667 0.0000 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.6667 0.0000 ( 1614 PWs) bands (ev): + + -4.8759 -3.5295 -3.5287 -2.5453 -0.6219 0.5095 0.5097 1.6905 + 2.4337 2.5475 2.5476 3.7172 3.8416 3.8426 4.0368 5.6034 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.6667 0.0000 ( 1622 PWs) bands (ev): + + -4.3043 -4.3032 -3.0834 -3.0824 -0.0673 -0.0670 1.4628 1.4629 + 1.9572 1.9575 3.0229 3.0232 4.0662 4.0664 4.8826 4.8828 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.6667 0.0000 ( 1614 PWs) bands (ev): + + -4.8759 -3.5295 -3.5287 -2.5453 -0.6219 0.5095 0.5097 1.6905 + 2.4337 2.5475 2.5476 3.7172 3.8416 3.8426 4.0368 5.6034 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.6667 0.0000 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.8333 0.0000 ( 1631 PWs) bands (ev): + + -5.7075 -2.8842 -1.6295 -1.6295 -1.6294 -1.6280 -0.3080 2.9706 + 2.9709 2.9709 2.9712 3.3993 3.3993 5.4728 5.7347 5.7347 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.8333 0.0000 ( 1638 PWs) bands (ev): + + -5.5865 -2.8060 -2.8052 -1.8052 -1.4057 -0.3443 -0.3438 2.2676 + 3.0058 3.0059 3.2056 3.2063 3.4838 4.5682 5.2900 6.0549 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.8333 0.0000 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.8333 0.0000 ( 1634 PWs) bands (ev): + + -4.6327 -4.6317 -2.2929 -2.2920 -0.7668 -0.7663 1.8971 1.8973 + 2.2355 2.2357 3.0447 3.0448 3.8053 3.8057 4.5234 4.5236 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.8333 0.0000 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.8333 0.0000 ( 1638 PWs) bands (ev): + + -5.5865 -2.8060 -2.8052 -1.8052 -1.4057 -0.3443 -0.3438 2.2676 + 3.0058 3.0059 3.2056 3.2063 3.4838 4.5682 5.2900 6.0549 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.0000 0.1667 ( 1631 PWs) bands (ev): + + -5.7075 -2.8842 -1.6295 -1.6295 -1.6294 -1.6280 -0.3080 2.9706 + 2.9709 2.9709 2.9712 3.3993 3.3993 5.4728 5.7347 5.7347 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.0000 0.1667 ( 1638 PWs) bands (ev): + + -5.5865 -2.8060 -2.8052 -1.8052 -1.4057 -0.3443 -0.3438 2.2676 + 3.0058 3.0059 3.2056 3.2063 3.4838 4.5682 5.2900 6.0549 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.0000 0.1667 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.0000 0.1667 ( 1634 PWs) bands (ev): + + -4.6327 -4.6317 -2.2929 -2.2920 -0.7668 -0.7663 1.8971 1.8973 + 2.2355 2.2357 3.0447 3.0448 3.8053 3.8057 4.5234 4.5236 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.0000 0.1667 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.0000 0.1667 ( 1638 PWs) bands (ev): + + -5.5865 -2.8060 -2.8052 -1.8052 -1.4057 -0.3443 -0.3438 2.2676 + 3.0058 3.0059 3.2056 3.2063 3.4838 4.5682 5.2900 6.0549 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.1667 0.1667 ( 1638 PWs) bands (ev): + + -5.5865 -2.8060 -2.8052 -1.8052 -1.4057 -0.3443 -0.3438 2.2676 + 3.0058 3.0059 3.2056 3.2063 3.4838 4.5682 5.2900 6.0549 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.1667 0.1667 ( 1629 PWs) bands (ev): + + -5.4668 -2.7475 -2.7475 -2.7464 -0.4124 -0.4124 -0.4118 2.4845 + 2.4845 2.4850 3.5892 3.5897 3.5897 3.7666 5.7163 5.7163 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.1667 0.1667 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.1667 0.1667 ( 1622 PWs) bands (ev): + + -4.5250 -4.5239 -2.5352 -2.5343 -0.6995 -0.6993 1.7096 1.7101 + 2.1037 2.1044 3.3674 3.3674 4.1495 4.1499 4.4034 4.4046 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.1667 0.1667 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.1667 0.1667 ( 1629 PWs) bands (ev): + + -5.4668 -2.7475 -2.7475 -2.7464 -0.4124 -0.4124 -0.4118 2.4845 + 2.4845 2.4850 3.5892 3.5897 3.5897 3.7666 5.7163 5.7163 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.3333 0.1667 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.3333 0.1667 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.3333 0.1667 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.3333 0.1667 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.3333 0.1667 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.3333 0.1667 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.5000 0.1667 ( 1634 PWs) bands (ev): + + -4.6327 -4.6317 -2.2929 -2.2920 -0.7668 -0.7663 1.8971 1.8973 + 2.2355 2.2357 3.0447 3.0448 3.8053 3.8057 4.5234 4.5236 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.5000 0.1667 ( 1622 PWs) bands (ev): + + -4.5250 -4.5239 -2.5352 -2.5343 -0.6995 -0.6993 1.7096 1.7101 + 2.1037 2.1044 3.3674 3.3674 4.1495 4.1499 4.4034 4.4046 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.5000 0.1667 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.5000 0.1667 ( 1640 PWs) bands (ev): + + -3.7124 -3.7122 -3.7122 -3.7104 0.1272 0.1277 0.1277 0.1283 + 3.0809 3.0817 3.0817 3.0824 4.8602 4.8607 4.8616 4.8616 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.5000 0.1667 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.5000 0.1667 ( 1622 PWs) bands (ev): + + -4.5250 -4.5239 -2.5352 -2.5343 -0.6995 -0.6993 1.7096 1.7101 + 2.1037 2.1044 3.3674 3.3674 4.1495 4.1499 4.4034 4.4046 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.6667 0.1667 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.6667 0.1667 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.6667 0.1667 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.6667 0.1667 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.6667 0.1667 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.6667 0.1667 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.8333 0.1667 ( 1638 PWs) bands (ev): + + -5.5865 -2.8060 -2.8052 -1.8052 -1.4057 -0.3443 -0.3438 2.2676 + 3.0058 3.0059 3.2056 3.2063 3.4838 4.5682 5.2900 6.0549 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.8333 0.1667 ( 1629 PWs) bands (ev): + + -5.4668 -2.7475 -2.7475 -2.7464 -0.4124 -0.4124 -0.4118 2.4845 + 2.4845 2.4850 3.5892 3.5897 3.5897 3.7666 5.7163 5.7163 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.8333 0.1667 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.8333 0.1667 ( 1622 PWs) bands (ev): + + -4.5250 -4.5239 -2.5352 -2.5343 -0.6995 -0.6993 1.7096 1.7101 + 2.1037 2.1044 3.3674 3.3674 4.1495 4.1499 4.4034 4.4046 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.8333 0.1667 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.8333 0.1667 ( 1629 PWs) bands (ev): + + -5.4668 -2.7475 -2.7475 -2.7464 -0.4124 -0.4124 -0.4118 2.4845 + 2.4845 2.4850 3.5892 3.5897 3.5897 3.7666 5.7163 5.7163 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.0000 0.3333 ( 1630 PWs) bands (ev): + + -5.3435 -3.9178 -1.5447 -1.5447 -1.5446 -1.5431 1.1472 2.4708 + 2.4710 2.4710 2.4711 3.7263 3.7263 4.1244 4.9616 4.9616 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.0000 0.3333 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.0000 0.3333 ( 1614 PWs) bands (ev): + + -4.8759 -3.5295 -3.5287 -2.5453 -0.6219 0.5095 0.5097 1.6905 + 2.4337 2.5475 2.5476 3.7172 3.8416 3.8426 4.0368 5.6034 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.0000 0.3333 ( 1622 PWs) bands (ev): + + -4.3043 -4.3032 -3.0834 -3.0824 -0.0673 -0.0670 1.4628 1.4629 + 1.9572 1.9575 3.0229 3.0232 4.0662 4.0664 4.8826 4.8828 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.0000 0.3333 ( 1614 PWs) bands (ev): + + -4.8759 -3.5295 -3.5287 -2.5453 -0.6219 0.5095 0.5097 1.6905 + 2.4337 2.5475 2.5476 3.7172 3.8416 3.8426 4.0368 5.6034 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.0000 0.3333 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.1667 0.3333 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.1667 0.3333 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.1667 0.3333 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.1667 0.3333 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.1667 0.3333 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.1667 0.3333 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.3333 0.3333 ( 1614 PWs) bands (ev): + + -4.8759 -3.5295 -3.5287 -2.5453 -0.6219 0.5095 0.5097 1.6905 + 2.4337 2.5475 2.5476 3.7172 3.8416 3.8426 4.0368 5.6034 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.3333 0.3333 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.3333 0.3333 ( 1634 PWs) bands (ev): + + -4.4457 -3.3229 -3.3229 -3.3216 -0.4774 -0.4773 -0.4773 0.7968 + 3.3569 3.3569 3.3580 4.3754 4.3760 4.3760 5.1611 5.1611 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.3333 0.3333 ( 1626 PWs) bands (ev): + + -3.9410 -3.9400 -3.2379 -3.2369 -0.7364 -0.7362 0.0308 0.0313 + 3.5393 3.5404 4.5043 4.5044 4.5740 4.5742 4.7487 4.7498 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.3333 0.3333 ( 1634 PWs) bands (ev): + + -4.4457 -3.3229 -3.3229 -3.3216 -0.4774 -0.4773 -0.4773 0.7968 + 3.3569 3.3569 3.3580 4.3754 4.3760 4.3760 5.1611 5.1611 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.3333 0.3333 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.5000 0.3333 ( 1622 PWs) bands (ev): + + -4.3043 -4.3032 -3.0834 -3.0824 -0.0673 -0.0670 1.4628 1.4629 + 1.9572 1.9575 3.0229 3.0232 4.0662 4.0664 4.8826 4.8828 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.5000 0.3333 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.5000 0.3333 ( 1626 PWs) bands (ev): + + -3.9410 -3.9400 -3.2379 -3.2369 -0.7364 -0.7362 0.0308 0.0313 + 3.5393 3.5404 4.5043 4.5044 4.5740 4.5742 4.7487 4.7498 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.5000 0.3333 ( 1628 PWs) bands (ev): + + -3.5663 -3.5662 -3.5662 -3.5643 -0.5674 -0.5668 -0.5668 -0.5665 + 4.2695 4.2702 4.2702 4.2710 4.9264 4.9268 4.9277 4.9277 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.5000 0.3333 ( 1626 PWs) bands (ev): + + -3.9410 -3.9400 -3.2379 -3.2369 -0.7364 -0.7362 0.0308 0.0313 + 3.5393 3.5404 4.5043 4.5044 4.5740 4.5742 4.7487 4.7498 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.5000 0.3333 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.6667 0.3333 ( 1614 PWs) bands (ev): + + -4.8759 -3.5295 -3.5287 -2.5453 -0.6219 0.5095 0.5097 1.6905 + 2.4337 2.5475 2.5476 3.7172 3.8416 3.8426 4.0368 5.6034 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.6667 0.3333 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.6667 0.3333 ( 1634 PWs) bands (ev): + + -4.4457 -3.3229 -3.3229 -3.3216 -0.4774 -0.4773 -0.4773 0.7968 + 3.3569 3.3569 3.3580 4.3754 4.3760 4.3760 5.1611 5.1611 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.6667 0.3333 ( 1626 PWs) bands (ev): + + -3.9410 -3.9400 -3.2379 -3.2369 -0.7364 -0.7362 0.0308 0.0313 + 3.5393 3.5404 4.5043 4.5044 4.5740 4.5742 4.7487 4.7498 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.6667 0.3333 ( 1634 PWs) bands (ev): + + -4.4457 -3.3229 -3.3229 -3.3216 -0.4774 -0.4773 -0.4773 0.7968 + 3.3569 3.3569 3.3580 4.3754 4.3760 4.3760 5.1611 5.1611 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.6667 0.3333 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.8333 0.3333 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.8333 0.3333 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.8333 0.3333 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.8333 0.3333 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.8333 0.3333 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.8333 0.3333 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.0000 0.5000 ( 1654 PWs) bands (ev): + + -4.7439 -4.7429 -1.4990 -1.4990 -1.4989 -1.4974 2.2575 2.2576 + 2.2576 2.2577 2.6433 2.6436 4.2570 4.2570 4.2581 4.2581 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.0000 0.5000 ( 1634 PWs) bands (ev): + + -4.6327 -4.6317 -2.2929 -2.2920 -0.7668 -0.7663 1.8971 1.8973 + 2.2355 2.2357 3.0447 3.0448 3.8053 3.8057 4.5234 4.5236 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.0000 0.5000 ( 1622 PWs) bands (ev): + + -4.3043 -4.3032 -3.0834 -3.0824 -0.0673 -0.0670 1.4628 1.4629 + 1.9572 1.9575 3.0229 3.0232 4.0662 4.0664 4.8826 4.8828 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.0000 0.5000 ( 1628 PWs) bands (ev): + + -3.7759 -3.7757 -3.7757 -3.7739 0.6684 0.6684 0.6685 0.6687 + 2.3603 2.3608 2.3608 2.3611 4.8292 4.8297 4.8305 4.8305 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.0000 0.5000 ( 1622 PWs) bands (ev): + + -4.3043 -4.3032 -3.0834 -3.0824 -0.0673 -0.0670 1.4628 1.4629 + 1.9572 1.9575 3.0229 3.0232 4.0662 4.0664 4.8826 4.8828 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.0000 0.5000 ( 1634 PWs) bands (ev): + + -4.6327 -4.6317 -2.2929 -2.2920 -0.7668 -0.7663 1.8971 1.8973 + 2.2355 2.2357 3.0447 3.0448 3.8053 3.8057 4.5234 4.5236 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.1667 0.5000 ( 1634 PWs) bands (ev): + + -4.6327 -4.6317 -2.2929 -2.2920 -0.7668 -0.7663 1.8971 1.8973 + 2.2355 2.2357 3.0447 3.0448 3.8053 3.8057 4.5234 4.5236 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.1667 0.5000 ( 1622 PWs) bands (ev): + + -4.5250 -4.5239 -2.5352 -2.5343 -0.6995 -0.6993 1.7096 1.7101 + 2.1037 2.1044 3.3674 3.3674 4.1495 4.1499 4.4034 4.4046 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.1667 0.5000 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.1667 0.5000 ( 1640 PWs) bands (ev): + + -3.7124 -3.7122 -3.7122 -3.7104 0.1272 0.1277 0.1277 0.1283 + 3.0809 3.0817 3.0817 3.0824 4.8602 4.8607 4.8616 4.8616 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.1667 0.5000 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.1667 0.5000 ( 1622 PWs) bands (ev): + + -4.5250 -4.5239 -2.5352 -2.5343 -0.6995 -0.6993 1.7096 1.7101 + 2.1037 2.1044 3.3674 3.3674 4.1495 4.1499 4.4034 4.4046 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.3333 0.5000 ( 1622 PWs) bands (ev): + + -4.3043 -4.3032 -3.0834 -3.0824 -0.0673 -0.0670 1.4628 1.4629 + 1.9572 1.9575 3.0229 3.0232 4.0662 4.0664 4.8826 4.8828 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.3333 0.5000 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.3333 0.5000 ( 1626 PWs) bands (ev): + + -3.9410 -3.9400 -3.2379 -3.2369 -0.7364 -0.7362 0.0308 0.0313 + 3.5393 3.5404 4.5043 4.5044 4.5740 4.5742 4.7487 4.7498 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.3333 0.5000 ( 1628 PWs) bands (ev): + + -3.5663 -3.5662 -3.5662 -3.5643 -0.5674 -0.5668 -0.5668 -0.5665 + 4.2695 4.2702 4.2702 4.2710 4.9264 4.9268 4.9277 4.9277 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.3333 0.5000 ( 1626 PWs) bands (ev): + + -3.9410 -3.9400 -3.2379 -3.2369 -0.7364 -0.7362 0.0308 0.0313 + 3.5393 3.5404 4.5043 4.5044 4.5740 4.5742 4.7487 4.7498 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.3333 0.5000 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.5000 0.5000 ( 1628 PWs) bands (ev): + + -3.7759 -3.7757 -3.7757 -3.7739 0.6684 0.6684 0.6685 0.6687 + 2.3603 2.3608 2.3608 2.3611 4.8292 4.8297 4.8305 4.8305 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.5000 0.5000 ( 1640 PWs) bands (ev): + + -3.7124 -3.7122 -3.7122 -3.7104 0.1272 0.1277 0.1277 0.1283 + 3.0809 3.0817 3.0817 3.0824 4.8602 4.8607 4.8616 4.8616 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.5000 0.5000 ( 1628 PWs) bands (ev): + + -3.5663 -3.5662 -3.5662 -3.5643 -0.5674 -0.5668 -0.5668 -0.5665 + 4.2695 4.2702 4.2702 4.2710 4.9264 4.9268 4.9277 4.9277 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.5000 0.5000 ( 1640 PWs) bands (ev): + + -3.4801 -3.4801 -3.4801 -3.4782 -0.8533 -0.8529 -0.8529 -0.8529 + 4.9609 4.9609 4.9613 4.9613 4.9613 4.9625 4.9625 4.9625 + 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1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.6667 0.5000 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.6667 0.5000 ( 1626 PWs) bands (ev): + + -3.9410 -3.9400 -3.2379 -3.2369 -0.7364 -0.7362 0.0308 0.0313 + 3.5393 3.5404 4.5043 4.5044 4.5740 4.5742 4.7487 4.7498 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.6667 0.5000 ( 1628 PWs) bands (ev): + + -3.5663 -3.5662 -3.5662 -3.5643 -0.5674 -0.5668 -0.5668 -0.5665 + 4.2695 4.2702 4.2702 4.2710 4.9264 4.9268 4.9277 4.9277 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.6667 0.5000 ( 1626 PWs) bands (ev): + + -3.9410 -3.9400 -3.2379 -3.2369 -0.7364 -0.7362 0.0308 0.0313 + 3.5393 3.5404 4.5043 4.5044 4.5740 4.5742 4.7487 4.7498 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.6667 0.5000 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.8333 0.5000 ( 1634 PWs) bands (ev): + + -4.6327 -4.6317 -2.2929 -2.2920 -0.7668 -0.7663 1.8971 1.8973 + 2.2355 2.2357 3.0447 3.0448 3.8053 3.8057 4.5234 4.5236 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.8333 0.5000 ( 1622 PWs) bands (ev): + + -4.5250 -4.5239 -2.5352 -2.5343 -0.6995 -0.6993 1.7096 1.7101 + 2.1037 2.1044 3.3674 3.3674 4.1495 4.1499 4.4034 4.4046 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.8333 0.5000 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.8333 0.5000 ( 1640 PWs) bands (ev): + + -3.7124 -3.7122 -3.7122 -3.7104 0.1272 0.1277 0.1277 0.1283 + 3.0809 3.0817 3.0817 3.0824 4.8602 4.8607 4.8616 4.8616 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.8333 0.5000 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.8333 0.5000 ( 1622 PWs) bands (ev): + + -4.5250 -4.5239 -2.5352 -2.5343 -0.6995 -0.6993 1.7096 1.7101 + 2.1037 2.1044 3.3674 3.3674 4.1495 4.1499 4.4034 4.4046 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.0000 0.6667 ( 1630 PWs) bands (ev): + + -5.3435 -3.9178 -1.5447 -1.5447 -1.5446 -1.5431 1.1472 2.4708 + 2.4710 2.4710 2.4711 3.7263 3.7263 4.1244 4.9616 4.9616 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.0000 0.6667 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.0000 0.6667 ( 1614 PWs) bands (ev): + + -4.8759 -3.5295 -3.5287 -2.5453 -0.6219 0.5095 0.5097 1.6905 + 2.4337 2.5475 2.5476 3.7172 3.8416 3.8426 4.0368 5.6034 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.0000 0.6667 ( 1622 PWs) bands (ev): + + -4.3043 -4.3032 -3.0834 -3.0824 -0.0673 -0.0670 1.4628 1.4629 + 1.9572 1.9575 3.0229 3.0232 4.0662 4.0664 4.8826 4.8828 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.0000 0.6667 ( 1614 PWs) bands (ev): + + -4.8759 -3.5295 -3.5287 -2.5453 -0.6219 0.5095 0.5097 1.6905 + 2.4337 2.5475 2.5476 3.7172 3.8416 3.8426 4.0368 5.6034 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.0000 0.6667 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.1667 0.6667 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.1667 0.6667 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.1667 0.6667 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.1667 0.6667 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.1667 0.6667 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.1667 0.6667 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.3333 0.6667 ( 1614 PWs) bands (ev): + + -4.8759 -3.5295 -3.5287 -2.5453 -0.6219 0.5095 0.5097 1.6905 + 2.4337 2.5475 2.5476 3.7172 3.8416 3.8426 4.0368 5.6034 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.3333 0.6667 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.3333 0.6667 ( 1634 PWs) bands (ev): + + -4.4457 -3.3229 -3.3229 -3.3216 -0.4774 -0.4773 -0.4773 0.7968 + 3.3569 3.3569 3.3580 4.3754 4.3760 4.3760 5.1611 5.1611 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.3333 0.6667 ( 1626 PWs) bands (ev): + + -3.9410 -3.9400 -3.2379 -3.2369 -0.7364 -0.7362 0.0308 0.0313 + 3.5393 3.5404 4.5043 4.5044 4.5740 4.5742 4.7487 4.7498 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.3333 0.6667 ( 1634 PWs) bands (ev): + + -4.4457 -3.3229 -3.3229 -3.3216 -0.4774 -0.4773 -0.4773 0.7968 + 3.3569 3.3569 3.3580 4.3754 4.3760 4.3760 5.1611 5.1611 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.3333 0.6667 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.5000 0.6667 ( 1622 PWs) bands (ev): + + -4.3043 -4.3032 -3.0834 -3.0824 -0.0673 -0.0670 1.4628 1.4629 + 1.9572 1.9575 3.0229 3.0232 4.0662 4.0664 4.8826 4.8828 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.5000 0.6667 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.5000 0.6667 ( 1626 PWs) bands (ev): + + -3.9410 -3.9400 -3.2379 -3.2369 -0.7364 -0.7362 0.0308 0.0313 + 3.5393 3.5404 4.5043 4.5044 4.5740 4.5742 4.7487 4.7498 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.5000 0.6667 ( 1628 PWs) bands (ev): + + -3.5663 -3.5662 -3.5662 -3.5643 -0.5674 -0.5668 -0.5668 -0.5665 + 4.2695 4.2702 4.2702 4.2710 4.9264 4.9268 4.9277 4.9277 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.5000 0.6667 ( 1626 PWs) bands (ev): + + -3.9410 -3.9400 -3.2379 -3.2369 -0.7364 -0.7362 0.0308 0.0313 + 3.5393 3.5404 4.5043 4.5044 4.5740 4.5742 4.7487 4.7498 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.5000 0.6667 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.6667 0.6667 ( 1614 PWs) bands (ev): + + -4.8759 -3.5295 -3.5287 -2.5453 -0.6219 0.5095 0.5097 1.6905 + 2.4337 2.5475 2.5476 3.7172 3.8416 3.8426 4.0368 5.6034 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.6667 0.6667 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.6667 0.6667 ( 1634 PWs) bands (ev): + + -4.4457 -3.3229 -3.3229 -3.3216 -0.4774 -0.4773 -0.4773 0.7968 + 3.3569 3.3569 3.3580 4.3754 4.3760 4.3760 5.1611 5.1611 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.6667 0.6667 ( 1626 PWs) bands (ev): + + -3.9410 -3.9400 -3.2379 -3.2369 -0.7364 -0.7362 0.0308 0.0313 + 3.5393 3.5404 4.5043 4.5044 4.5740 4.5742 4.7487 4.7498 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.6667 0.6667 ( 1634 PWs) bands (ev): + + -4.4457 -3.3229 -3.3229 -3.3216 -0.4774 -0.4773 -0.4773 0.7968 + 3.3569 3.3569 3.3580 4.3754 4.3760 4.3760 5.1611 5.1611 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.6667 0.6667 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.8333 0.6667 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.8333 0.6667 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.8333 0.6667 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.8333 0.6667 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.8333 0.6667 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9034 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.8333 0.6667 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.0000 0.8333 ( 1631 PWs) bands (ev): + + -5.7075 -2.8842 -1.6295 -1.6295 -1.6294 -1.6280 -0.3080 2.9706 + 2.9709 2.9709 2.9712 3.3993 3.3993 5.4728 5.7347 5.7347 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.0000 0.8333 ( 1638 PWs) bands (ev): + + -5.5865 -2.8060 -2.8052 -1.8052 -1.4057 -0.3443 -0.3438 2.2676 + 3.0058 3.0059 3.2056 3.2063 3.4838 4.5682 5.2900 6.0549 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.0000 0.8333 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.0000 0.8333 ( 1634 PWs) bands (ev): + + -4.6327 -4.6317 -2.2929 -2.2920 -0.7668 -0.7663 1.8971 1.8973 + 2.2355 2.2357 3.0447 3.0448 3.8053 3.8057 4.5234 4.5236 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.0000 0.8333 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.0000 0.8333 ( 1638 PWs) bands (ev): + + -5.5865 -2.8060 -2.8052 -1.8052 -1.4057 -0.3443 -0.3438 2.2676 + 3.0058 3.0059 3.2056 3.2063 3.4838 4.5682 5.2900 6.0549 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.1667 0.8333 ( 1638 PWs) bands (ev): + + -5.5865 -2.8060 -2.8052 -1.8052 -1.4057 -0.3443 -0.3438 2.2676 + 3.0058 3.0059 3.2056 3.2063 3.4838 4.5682 5.2900 6.0549 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.1667 0.8333 ( 1629 PWs) bands (ev): + + -5.4668 -2.7475 -2.7475 -2.7464 -0.4124 -0.4124 -0.4118 2.4845 + 2.4845 2.4850 3.5892 3.5897 3.5897 3.7666 5.7163 5.7163 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.1667 0.8333 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.1667 0.8333 ( 1622 PWs) bands (ev): + + -4.5250 -4.5239 -2.5352 -2.5343 -0.6995 -0.6993 1.7096 1.7101 + 2.1037 2.1044 3.3674 3.3674 4.1495 4.1499 4.4034 4.4046 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.1667 0.8333 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.1667 0.8333 ( 1629 PWs) bands (ev): + + -5.4668 -2.7475 -2.7475 -2.7464 -0.4124 -0.4124 -0.4118 2.4845 + 2.4845 2.4850 3.5892 3.5897 3.5897 3.7666 5.7163 5.7163 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.3333 0.8333 ( 1627 PWs) bands (ev): + + -5.2259 -3.8183 -2.5884 -2.0119 -1.1054 -0.4876 0.9706 1.8545 + 2.3463 2.9733 3.2916 3.3603 3.4276 3.7279 4.5084 5.4576 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.3333 0.8333 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.3333 0.8333 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.3333 0.8333 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 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1622 PWs) bands (ev): + + -4.5250 -4.5239 -2.5352 -2.5343 -0.6995 -0.6993 1.7096 1.7101 + 2.1037 2.1044 3.3674 3.3674 4.1495 4.1499 4.4034 4.4046 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.5000 0.8333 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.5000 0.8333 ( 1640 PWs) bands (ev): + + -3.7124 -3.7122 -3.7122 -3.7104 0.1272 0.1277 0.1277 0.1283 + 3.0809 3.0817 3.0817 3.0824 4.8602 4.8607 4.8616 4.8616 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.5000 0.8333 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 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2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.6667 0.8333 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.6667 0.8333 ( 1626 PWs) bands (ev): + + -4.2092 -4.2082 -3.1011 -3.1002 -0.4099 -0.4095 0.8671 0.8677 + 2.5346 2.5354 3.7012 3.7017 4.1730 4.1731 4.8466 4.8469 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.6667 0.8333 ( 1631 PWs) bands (ev): + + -4.7666 -3.4669 -3.4661 -2.7675 -0.6603 0.1159 0.1160 1.7370 + 2.2192 2.9033 2.9035 4.0155 4.0163 4.1243 4.4560 5.4830 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.6667 0.8333 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.0000 0.8333 0.8333 ( 1638 PWs) bands (ev): + + -5.5865 -2.8060 -2.8052 -1.8052 -1.4057 -0.3443 -0.3438 2.2676 + 3.0058 3.0059 3.2056 3.2063 3.4838 4.5682 5.2900 6.0549 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.1667 0.8333 0.8333 ( 1629 PWs) bands (ev): + + -5.4668 -2.7475 -2.7475 -2.7464 -0.4124 -0.4124 -0.4118 2.4845 + 2.4845 2.4850 3.5892 3.5897 3.5897 3.7666 5.7163 5.7163 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.3333 0.8333 0.8333 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.5000 0.8333 0.8333 ( 1622 PWs) bands (ev): + + -4.5250 -4.5239 -2.5352 -2.5343 -0.6995 -0.6993 1.7096 1.7101 + 2.1037 2.1044 3.3674 3.3674 4.1495 4.1499 4.4034 4.4046 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.6667 0.8333 0.8333 ( 1636 PWs) bands (ev): + + -5.1101 -3.7262 -2.6139 -2.6130 -0.5890 -0.5887 0.6948 2.1636 + 2.1642 2.7146 3.1397 3.5148 3.5150 3.9022 5.0491 5.2307 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + k = 0.8333 0.8333 0.8333 ( 1629 PWs) bands (ev): + + -5.4668 -2.7475 -2.7475 -2.7464 -0.4124 -0.4124 -0.4118 2.4845 + 2.4845 2.4850 3.5892 3.5897 3.5897 3.7666 5.7163 5.7163 + + occupation numbers + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 + + highest occupied level (ev): 6.1733 + + Writing output data file /home/ponet/.julia/dev/DFControl/docs/build/guide/Job2/outputs/Si.save/ + + init_run : 0.13s CPU 0.13s WALL ( 1 calls) + electrons : 10.19s CPU 10.30s WALL ( 1 calls) + + Called by init_run: + wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) + wfcinit:atom : 0.01s CPU 0.01s WALL ( 54 calls) + wfcinit:wfcr : 0.68s CPU 0.68s WALL ( 54 calls) + potinit : 0.05s CPU 0.05s WALL ( 1 calls) + hinit0 : 0.06s CPU 0.06s WALL ( 1 calls) + + Called by electrons: + c_bands : 10.18s CPU 10.30s WALL ( 1 calls) + v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) + v_h : 0.00s CPU 0.00s WALL ( 1 calls) + v_xc : 0.01s CPU 0.01s WALL ( 1 calls) + newd : 0.00s CPU 0.00s WALL ( 1 calls) + PAW_pot : 0.04s CPU 0.04s WALL ( 1 calls) + + Called by c_bands: + init_us_2 : 0.02s CPU 0.02s WALL ( 54 calls) + cegterg : 9.13s CPU 9.23s WALL ( 108 calls) + + Called by sum_band: + + Called by *egterg: + cdiaghg : 0.32s CPU 0.32s WALL ( 1506 calls) + cegterg:over : 0.39s CPU 0.40s WALL ( 1452 calls) + cegterg:upda : 0.20s CPU 0.20s WALL ( 1452 calls) + cegterg:last : 0.52s CPU 0.52s WALL ( 1238 calls) + h_psi : 7.60s CPU 7.69s WALL ( 1614 calls) + s_psi : 0.53s CPU 0.54s WALL ( 1614 calls) + g_psi : 0.08s CPU 0.08s WALL ( 1452 calls) + + Called by h_psi: + h_psi:calbec : 0.47s CPU 0.48s WALL ( 1614 calls) + vloc_psi : 6.53s CPU 6.60s WALL ( 1614 calls) + add_vuspsi : 0.56s CPU 0.56s WALL ( 1614 calls) + + General routines + calbec : 0.47s CPU 0.47s WALL ( 1614 calls) + fft : 0.00s CPU 0.00s WALL ( 12 calls) + fftw : 5.73s CPU 5.80s WALL ( 44104 calls) + davcio : 0.00s CPU 0.01s WALL ( 108 calls) + + Parallel routines + + PAW routines + PAW_pot : 0.04s CPU 0.04s WALL ( 1 calls) + + PWSCF : 10.63s CPU 10.77s WALL + + + This run was terminated on: 17:32: 4 16Jun2021 + +=------------------------------------------------------------------------------= + JOB DONE. +=------------------------------------------------------------------------------= diff --git a/docs/src/assets/job/Job2/projwfc.in b/docs/src/assets/job/Job2/projwfc.in new file mode 100644 index 00000000..cce20ce7 --- /dev/null +++ b/docs/src/assets/job/Job2/projwfc.in @@ -0,0 +1,229 @@ +&projwfc + prefix = 'Si' + Emin = -3.9729 + Emax = 8.0271 + DeltaE = 0.1 + ngauss = 0 + outdir = '/home/ponet/.julia/dev/DFControl/docs/build/guide/Job2/outputs' + degauss = 0.0 +/ + +K_POINTS (crystal) +216 + 0.0 0.0 0.0 0.004629629629629629 + 0.16666666666666666 0.0 0.0 0.004629629629629629 + 0.3333333333333333 0.0 0.0 0.004629629629629629 + 0.5 0.0 0.0 0.004629629629629629 + 0.6666666666666666 0.0 0.0 0.004629629629629629 + 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0.8333333333333334 0.004629629629629629 + diff --git a/docs/src/assets/job/Job2/projwfc.out b/docs/src/assets/job/Job2/projwfc.out new file mode 100644 index 00000000..07f710ef --- /dev/null +++ b/docs/src/assets/job/Job2/projwfc.out @@ -0,0 +1,29747 @@ + + Program PROJWFC v.6.7GPU starts on 16Jun2021 at 17:32: 4 + + This program is part of the open-source Quantum ESPRESSO suite + for quantum simulation of materials; please cite + "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); + "P. Giannozzi et al., J. Phys.:Condens. Matter 29 465901 (2017); + "P. Giannozzi et al., J. Chem. Phys. 152 154105 (2020); + URL http://www.quantum-espresso.org", + in publications or presentations arising from this work. More details at + http://www.quantum-espresso.org/quote + + Parallel version (MPI), running on 4 processors + + MPI processes distributed on 1 nodes + R & G space division: proc/nbgrp/npool/nimage = 4 + + Reading xml data from directory: + + /home/ponet/.julia/dev/DFControl/docs/build/guide/Job2/outputs/Si.save/ + file Si.pbesol-n-kjpaw_psl.0.1.UPF: wavefunction(s) 3S renormalized + + IMPORTANT: XC functional enforced from input : + Exchange-correlation= PBESOL + ( 1 4 10 8 0 0 0) + Any further DFT definition will be discarded + Please, verify this is what you really want + + + Parallelization info + -------------------- + sticks: dense smooth PW G-vecs: dense smooth PW + Min 168 168 60 3282 3282 700 + Max 169 169 61 3284 3284 701 + Sum 673 673 241 13133 13133 2801 + + Using Slab Decomposition + + + Check: negative core charge= -0.000010 + + Gaussian broadening (default values): ngauss,degauss= 0 0.007350 + + + Calling projwave .... + + Subspace diagonalization in iterative solution of the eigenvalue problem: + one sub-group per band group will be used + scalapack distributed-memory algorithm (size of sub-group: 2* 2 procs) + + linear algebra parallelized on 4 procs + + Problem Sizes + natomwfc = 32 + nx = 16 + nbnd = 16 + nkstot = 216 + npwx = 426 + nkb = 64 + + + Atomic states used for projection + (read from pseudopotential files): + + state # 1: atom 1 (Si ), wfc 1 (l=0 m= 1) + state # 2: atom 1 (Si ), wfc 2 (l=1 m= 1) + state # 3: atom 1 (Si ), wfc 2 (l=1 m= 2) + state # 4: atom 1 (Si ), wfc 2 (l=1 m= 3) + state # 5: atom 2 (Si ), wfc 1 (l=0 m= 1) + state # 6: atom 2 (Si ), wfc 2 (l=1 m= 1) + state # 7: atom 2 (Si ), wfc 2 (l=1 m= 2) + state # 8: atom 2 (Si ), wfc 2 (l=1 m= 3) + state # 9: atom 3 (Si ), wfc 1 (l=0 m= 1) + state # 10: atom 3 (Si ), wfc 2 (l=1 m= 1) + state # 11: atom 3 (Si ), wfc 2 (l=1 m= 2) + state # 12: atom 3 (Si ), wfc 2 (l=1 m= 3) + state # 13: atom 4 (Si ), wfc 1 (l=0 m= 1) + state # 14: atom 4 (Si ), wfc 2 (l=1 m= 1) + state # 15: atom 4 (Si ), wfc 2 (l=1 m= 2) + state # 16: atom 4 (Si ), wfc 2 (l=1 m= 3) + state # 17: atom 5 (Si ), wfc 1 (l=0 m= 1) + state # 18: atom 5 (Si ), wfc 2 (l=1 m= 1) + state # 19: atom 5 (Si ), wfc 2 (l=1 m= 2) + state # 20: atom 5 (Si ), wfc 2 (l=1 m= 3) + state # 21: atom 6 (Si ), wfc 1 (l=0 m= 1) + state # 22: atom 6 (Si ), wfc 2 (l=1 m= 1) + state # 23: atom 6 (Si ), wfc 2 (l=1 m= 2) + state # 24: atom 6 (Si ), wfc 2 (l=1 m= 3) + state # 25: atom 7 (Si ), wfc 1 (l=0 m= 1) + state # 26: atom 7 (Si ), wfc 2 (l=1 m= 1) + state # 27: atom 7 (Si ), wfc 2 (l=1 m= 2) + state # 28: atom 7 (Si ), wfc 2 (l=1 m= 3) + state # 29: atom 8 (Si ), wfc 1 (l=0 m= 1) + state # 30: atom 8 (Si ), wfc 2 (l=1 m= 1) + state # 31: atom 8 (Si ), wfc 2 (l=1 m= 2) + state # 32: atom 8 (Si ), wfc 2 (l=1 m= 3) + + k = 0.0000000000 0.0000000000 0.0000000000 +==== e( 1) = -5.82942 eV ==== + psi = 0.124*[# 5]+0.124*[# 9]+0.124*[# 13]+0.124*[# 17]+0.124*[# 21] + +0.124*[# 25]+0.124*[# 29]+0.124*[# 1] + |psi|^2 = 0.992 +==== e( 2) = -1.66897 eV ==== + psi = 0.145*[# 9]+0.145*[# 17]+0.145*[# 21]+0.145*[# 25]+0.020*[# 2] + +0.020*[# 3]+0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 16]+0.020*[# 30]+0.020*[# 31] + +0.020*[# 32] + |psi|^2 = 0.823 +==== e( 3) = -1.66897 eV ==== + psi = 0.145*[# 9]+0.145*[# 17]+0.145*[# 21]+0.145*[# 25]+0.029*[# 2] + +0.029*[# 3]+0.029*[# 4]+0.029*[# 6]+0.029*[# 7]+0.029*[# 8] + +0.029*[# 14]+0.029*[# 15]+0.029*[# 16]+0.029*[# 30]+0.029*[# 31] + +0.029*[# 32] + |psi|^2 = 0.931 +==== e( 4) = -1.66897 eV ==== + psi = 0.145*[# 9]+0.145*[# 17]+0.145*[# 21]+0.145*[# 25]+0.039*[# 2] + +0.039*[# 3]+0.039*[# 4]+0.039*[# 6]+0.039*[# 7]+0.039*[# 8] + +0.039*[# 14]+0.039*[# 15]+0.039*[# 16]+0.039*[# 30]+0.039*[# 31] + +0.039*[# 32] + |psi|^2 = 1.048 +==== e( 5) = -1.66885 eV ==== + psi = 0.193*[# 5]+0.193*[# 13]+0.193*[# 29]+0.034*[# 10]+0.034*[# 11] + +0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22] + +0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28] + + |psi|^2 = 0.993 +==== e( 6) = -1.66885 eV ==== + psi = 0.193*[# 5]+0.193*[# 13]+0.193*[# 29]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + + |psi|^2 = 0.911 +==== e( 7) = -1.66679 eV ==== + psi = 0.434*[# 1]+0.048*[# 5]+0.048*[# 13]+0.048*[# 29]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28] + |psi|^2 = 1.130 +==== e( 8) = 3.28861 eV ==== + psi = 0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.036*[# 6]+0.036*[# 8]+0.036*[# 14] + +0.036*[# 15]+0.036*[# 31]+0.036*[# 32] + |psi|^2 = 0.689 +==== e( 9) = 3.28861 eV ==== + psi = 0.083*[# 6]+0.083*[# 8]+0.083*[# 14]+0.083*[# 15]+0.083*[# 31] + +0.083*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + |psi|^2 = 0.994 +==== e( 10) = 3.28861 eV ==== + psi = 0.087*[# 6]+0.087*[# 8]+0.087*[# 14]+0.087*[# 15]+0.087*[# 31] + +0.087*[# 32]+0.057*[# 7]+0.057*[# 16]+0.057*[# 30]+0.033*[# 10] + +0.033*[# 11]+0.033*[# 12]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28] + |psi|^2 = 1.093 +==== e( 11) = 3.28934 eV ==== + psi = 0.082*[# 2]+0.082*[# 3]+0.082*[# 4]+0.082*[# 7]+0.082*[# 16] + +0.082*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32] + |psi|^2 = 1.063 +==== e( 12) = 3.28934 eV ==== + psi = 0.052*[# 10]+0.052*[# 11]+0.052*[# 12]+0.052*[# 18]+0.052*[# 19] + +0.052*[# 20]+0.052*[# 22]+0.052*[# 23]+0.052*[# 24]+0.052*[# 26] + +0.052*[# 27]+0.052*[# 28]+0.041*[# 7]+0.041*[# 16]+0.041*[# 30] + +0.022*[# 2]+0.022*[# 3]+0.022*[# 4]+0.009*[# 6]+0.009*[# 8] + +0.009*[# 14]+0.009*[# 15]+0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.868 +==== e( 13) = 3.28934 eV ==== + psi = 0.083*[# 2]+0.083*[# 3]+0.083*[# 4]+0.083*[# 7]+0.083*[# 16] + +0.083*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + |psi|^2 = 0.994 +==== e( 14) = 6.17328 eV ==== + psi = 0.046*[# 10]+0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19] + +0.046*[# 20]+0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26] + +0.046*[# 27]+0.046*[# 28]+0.044*[# 2]+0.044*[# 3]+0.044*[# 4] + +0.036*[# 6]+0.036*[# 8]+0.036*[# 14]+0.036*[# 15]+0.036*[# 31] + +0.036*[# 32]+0.029*[# 7]+0.029*[# 16]+0.029*[# 30] + |psi|^2 = 0.980 +==== e( 15) = 6.17328 eV ==== + psi = 0.036*[# 2]+0.036*[# 3]+0.036*[# 4]+0.036*[# 6]+0.036*[# 7] + +0.036*[# 8]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 14] + +0.036*[# 15]+0.036*[# 16]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.036*[# 30]+0.036*[# 31]+0.036*[# 32] + |psi|^2 = 0.859 +==== e( 16) = 6.17328 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.037*[# 6]+0.037*[# 7] + +0.037*[# 8]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 16]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.037*[# 30]+0.037*[# 31]+0.037*[# 32] + |psi|^2 = 0.882 + + k = 0.1666666667 0.0000000000 0.0000000000 +==== e( 1) = -5.70745 eV ==== + psi = 0.117*[# 5]+0.117*[# 9]+0.117*[# 13]+0.117*[# 17]+0.117*[# 21] + +0.117*[# 25]+0.117*[# 29]+0.117*[# 1]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.002*[# 6]+0.002*[# 7]+0.002*[# 8]+0.002*[# 10] + +0.002*[# 11]+0.002*[# 12]+0.002*[# 14]+0.002*[# 15]+0.002*[# 16] + +0.002*[# 18]+0.002*[# 19]+0.002*[# 20]+0.002*[# 22]+0.002*[# 23] + +0.002*[# 24]+0.002*[# 26]+0.002*[# 27]+0.002*[# 28]+0.002*[# 30] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.88416 eV ==== + psi = 0.077*[# 5]+0.077*[# 9]+0.077*[# 13]+0.077*[# 17]+0.077*[# 21] + +0.077*[# 25]+0.077*[# 29]+0.076*[# 1]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 1.050 +==== e( 3) = -1.62947 eV ==== + psi = 0.147*[# 9]+0.147*[# 17]+0.147*[# 21]+0.147*[# 25]+0.009*[# 7] + +0.009*[# 16]+0.009*[# 30]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4] + |psi|^2 = 0.678 +==== e( 4) = -1.62947 eV ==== + psi = 0.147*[# 9]+0.147*[# 17]+0.147*[# 21]+0.147*[# 25]+0.044*[# 2] + +0.044*[# 3]+0.044*[# 4]+0.042*[# 6]+0.042*[# 8]+0.042*[# 14] + +0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.040*[# 7]+0.040*[# 16] + +0.040*[# 30]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 18] + +0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23]+0.016*[# 24] + +0.016*[# 26]+0.016*[# 27]+0.016*[# 28] + |psi|^2 = 1.284 +==== e( 5) = -1.62936 eV ==== + psi = 0.196*[# 5]+0.196*[# 13]+0.196*[# 29]+0.034*[# 10]+0.034*[# 11] + +0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22] + +0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28] + + |psi|^2 = 0.993 +==== e( 6) = -1.62795 eV ==== + psi = 0.294*[# 1]+0.098*[# 5]+0.098*[# 13]+0.098*[# 29]+0.017*[# 10] + +0.017*[# 11]+0.017*[# 12]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20] + +0.017*[# 22]+0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27] + +0.017*[# 28] + |psi|^2 = 0.791 +==== e( 7) = -0.30800 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 9]+0.068*[# 13]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.068*[# 29]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.019*[# 2]+0.019*[# 3]+0.019*[# 4]+0.019*[# 6]+0.019*[# 7] + +0.019*[# 8]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.195 +==== e( 8) = 2.97062 eV ==== + psi = 0.075*[# 6]+0.075*[# 8]+0.075*[# 14]+0.075*[# 15]+0.075*[# 31] + +0.075*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.004*[# 5]+0.004*[# 13] + +0.004*[# 29] + |psi|^2 = 0.727 +==== e( 9) = 2.97089 eV ==== + psi = 0.045*[# 6]+0.045*[# 8]+0.045*[# 14]+0.045*[# 15]+0.045*[# 31] + +0.045*[# 32]+0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.044*[# 7] + +0.044*[# 16]+0.044*[# 30]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.003*[# 9] + +0.003*[# 17]+0.003*[# 21]+0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.97089 eV ==== + psi = 0.075*[# 10]+0.075*[# 11]+0.075*[# 12]+0.075*[# 18]+0.075*[# 19] + +0.075*[# 20]+0.075*[# 22]+0.075*[# 23]+0.075*[# 24]+0.075*[# 26] + +0.075*[# 27]+0.075*[# 28]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15]+0.009*[# 31] + +0.009*[# 32]+0.007*[# 7]+0.007*[# 16]+0.007*[# 30]+0.003*[# 9] + +0.003*[# 17]+0.003*[# 21]+0.003*[# 25] + |psi|^2 = 1.014 +==== e( 11) = 2.97118 eV ==== + psi = 0.112*[# 7]+0.112*[# 16]+0.112*[# 30]+0.108*[# 2]+0.108*[# 3] + +0.108*[# 4]+0.036*[# 6]+0.036*[# 8]+0.036*[# 14]+0.036*[# 15] + +0.036*[# 31]+0.036*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12] + +0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23] + +0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 1] + +0.002*[# 5]+0.002*[# 13]+0.002*[# 29] + |psi|^2 = 1.153 +==== e( 12) = 3.39927 eV ==== + psi = 0.053*[# 10]+0.053*[# 11]+0.053*[# 12]+0.053*[# 18]+0.053*[# 19] + +0.053*[# 20]+0.053*[# 22]+0.053*[# 23]+0.053*[# 24]+0.053*[# 26] + +0.053*[# 27]+0.053*[# 28]+0.025*[# 2]+0.025*[# 3]+0.025*[# 4] + +0.025*[# 6]+0.025*[# 7]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15] + +0.025*[# 16]+0.025*[# 30]+0.025*[# 31]+0.025*[# 32] + |psi|^2 = 0.941 +==== e( 13) = 3.39927 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 5.47279 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32]+0.022*[# 1] + +0.022*[# 5]+0.022*[# 9]+0.022*[# 13]+0.022*[# 17]+0.022*[# 21] + +0.022*[# 25]+0.022*[# 29] + |psi|^2 = 0.969 +==== e( 15) = 5.73469 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 14]+0.040*[# 15]+0.040*[# 16]+0.040*[# 30] + +0.040*[# 31]+0.040*[# 32]+0.019*[# 10]+0.019*[# 11]+0.019*[# 12] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28] + |psi|^2 = 0.710 +==== e( 16) = 5.73469 eV ==== + psi = 0.054*[# 10]+0.054*[# 11]+0.054*[# 12]+0.054*[# 18]+0.054*[# 19] + +0.054*[# 20]+0.054*[# 22]+0.054*[# 23]+0.054*[# 24]+0.054*[# 26] + +0.054*[# 27]+0.054*[# 28]+0.034*[# 2]+0.034*[# 3]+0.034*[# 4] + +0.034*[# 6]+0.034*[# 7]+0.034*[# 8]+0.034*[# 14]+0.034*[# 15] + +0.034*[# 16]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32] + |psi|^2 = 1.056 + + k = 0.3333333333 0.0000000000 0.0000000000 +==== e( 1) = -5.34348 eV ==== + psi = 0.103*[# 5]+0.103*[# 9]+0.103*[# 13]+0.103*[# 17]+0.103*[# 21] + +0.103*[# 25]+0.103*[# 29]+0.103*[# 1]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4]+0.007*[# 6]+0.007*[# 7]+0.007*[# 8]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 14]+0.007*[# 15]+0.007*[# 16] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.007*[# 30] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.91783 eV ==== + psi = 0.082*[# 1]+0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.082*[# 29]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 7]+0.021*[# 8]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 14]+0.021*[# 15]+0.021*[# 16] + +0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23] + +0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.021*[# 30] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.163 +==== e( 3) = -1.54469 eV ==== + psi = 0.152*[# 9]+0.152*[# 17]+0.152*[# 21]+0.152*[# 25]+0.022*[# 7] + +0.022*[# 16]+0.022*[# 30]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14] + +0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4] + |psi|^2 = 0.819 +==== e( 4) = -1.54469 eV ==== + psi = 0.152*[# 9]+0.152*[# 17]+0.152*[# 21]+0.152*[# 25]+0.033*[# 2] + +0.033*[# 3]+0.033*[# 4]+0.029*[# 6]+0.029*[# 8]+0.029*[# 14] + +0.029*[# 15]+0.029*[# 31]+0.029*[# 32]+0.024*[# 7]+0.024*[# 16] + +0.024*[# 30]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12]+0.014*[# 18] + +0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24] + +0.014*[# 26]+0.014*[# 27]+0.014*[# 28] + |psi|^2 = 1.119 +==== e( 5) = -1.54458 eV ==== + psi = 0.202*[# 5]+0.202*[# 13]+0.202*[# 29]+0.032*[# 10]+0.032*[# 11] + +0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22] + +0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + + |psi|^2 = 0.994 +==== e( 6) = -1.54312 eV ==== + psi = 0.304*[# 1]+0.101*[# 5]+0.101*[# 13]+0.101*[# 29]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28] + |psi|^2 = 0.802 +==== e( 7) = 1.14721 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 6]+0.020*[# 7] + +0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.184 +==== e( 8) = 2.47079 eV ==== + psi = 0.066*[# 6]+0.066*[# 8]+0.066*[# 14]+0.066*[# 15]+0.066*[# 31] + +0.066*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.003*[# 5]+0.003*[# 13] + +0.003*[# 29] + |psi|^2 = 0.700 +==== e( 9) = 2.47096 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 6]+0.049*[# 7] + +0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 16]+0.049*[# 30] + +0.049*[# 31]+0.049*[# 32]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.002*[# 9] + +0.002*[# 17]+0.002*[# 21]+0.002*[# 25] + |psi|^2 = 0.994 +==== e( 10) = 2.47096 eV ==== + psi = 0.066*[# 10]+0.066*[# 11]+0.066*[# 12]+0.066*[# 18]+0.066*[# 19] + +0.066*[# 20]+0.066*[# 22]+0.066*[# 23]+0.066*[# 24]+0.066*[# 26] + +0.066*[# 27]+0.066*[# 28]+0.048*[# 7]+0.048*[# 16]+0.048*[# 30] + +0.026*[# 6]+0.026*[# 8]+0.026*[# 14]+0.026*[# 15]+0.026*[# 31] + +0.026*[# 32]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4]+0.002*[# 9] + +0.002*[# 17]+0.002*[# 21]+0.002*[# 25] + |psi|^2 = 1.110 +==== e( 11) = 2.47113 eV ==== + psi = 0.112*[# 2]+0.112*[# 3]+0.112*[# 4]+0.067*[# 7]+0.067*[# 16] + +0.067*[# 30]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.004*[# 1] + +0.002*[# 5]+0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.980 +==== e( 12) = 3.72629 eV ==== + psi = 0.049*[# 10]+0.049*[# 11]+0.049*[# 12]+0.049*[# 18]+0.049*[# 19] + +0.049*[# 20]+0.049*[# 22]+0.049*[# 23]+0.049*[# 24]+0.049*[# 26] + +0.049*[# 27]+0.049*[# 28]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.026*[# 6]+0.026*[# 7]+0.026*[# 8]+0.026*[# 14]+0.026*[# 15] + +0.026*[# 16]+0.026*[# 30]+0.026*[# 31]+0.026*[# 32] + |psi|^2 = 0.889 +==== e( 13) = 3.72629 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.993 +==== e( 14) = 4.12437 eV ==== + psi = 0.043*[# 1]+0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17] + +0.043*[# 21]+0.043*[# 25]+0.043*[# 29]+0.026*[# 2]+0.026*[# 3] + +0.026*[# 4]+0.026*[# 6]+0.026*[# 7]+0.026*[# 8]+0.026*[# 10] + +0.026*[# 11]+0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 16] + +0.026*[# 18]+0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23] + +0.026*[# 24]+0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.026*[# 30] + +0.026*[# 31]+0.026*[# 32] + |psi|^2 = 0.979 +==== e( 15) = 4.96156 eV ==== + psi = 0.031*[# 2]+0.031*[# 3]+0.031*[# 4]+0.031*[# 6]+0.031*[# 7] + +0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 16]+0.031*[# 30] + +0.031*[# 31]+0.031*[# 32]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12] + +0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23] + +0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28] + |psi|^2 = 0.653 +==== e( 16) = 4.96156 eV ==== + psi = 0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18]+0.044*[# 19] + +0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24]+0.044*[# 26] + +0.044*[# 27]+0.044*[# 28]+0.036*[# 2]+0.036*[# 3]+0.036*[# 4] + +0.036*[# 6]+0.036*[# 7]+0.036*[# 8]+0.036*[# 14]+0.036*[# 15] + +0.036*[# 16]+0.036*[# 30]+0.036*[# 31]+0.036*[# 32] + |psi|^2 = 0.965 + + k = 0.5000000000 0.0000000000 0.0000000000 +==== e( 1) = -4.74394 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4] + +0.022*[# 7]+0.022*[# 16]+0.022*[# 30]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + + |psi|^2 = 0.993 +==== e( 2) = -4.74289 eV ==== + psi = 0.181*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.022*[# 2] + +0.022*[# 3]+0.022*[# 4]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12] + +0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23] + +0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + |psi|^2 = 1.261 +==== e( 3) = -1.49898 eV ==== + psi = 0.155*[# 9]+0.155*[# 17]+0.155*[# 21]+0.155*[# 25]+0.029*[# 7] + +0.029*[# 16]+0.029*[# 30]+0.016*[# 6]+0.016*[# 8]+0.016*[# 14] + +0.016*[# 15]+0.016*[# 31]+0.016*[# 32]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.807 +==== e( 4) = -1.49898 eV ==== + psi = 0.155*[# 9]+0.155*[# 17]+0.155*[# 21]+0.155*[# 25]+0.029*[# 2] + +0.029*[# 3]+0.029*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14] + +0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.024*[# 7]+0.024*[# 16] + +0.024*[# 30]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12]+0.011*[# 18] + +0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24] + +0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + |psi|^2 = 1.075 +==== e( 5) = -1.49886 eV ==== + psi = 0.206*[# 5]+0.206*[# 13]+0.206*[# 29]+0.031*[# 10]+0.031*[# 11] + +0.031*[# 12]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22] + +0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + + |psi|^2 = 0.995 +==== e( 6) = -1.49736 eV ==== + psi = 0.310*[# 1]+0.103*[# 5]+0.103*[# 13]+0.103*[# 29]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28] + |psi|^2 = 0.807 +==== e( 7) = 2.25746 eV ==== + psi = 0.064*[# 6]+0.064*[# 8]+0.064*[# 14]+0.064*[# 15]+0.064*[# 31] + +0.064*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + |psi|^2 = 0.876 +==== e( 8) = 2.25759 eV ==== + psi = 0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.032*[# 10]+0.032*[# 11] + +0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22] + +0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.012*[# 2]+0.012*[# 3]+0.012*[# 4] + |psi|^2 = 0.688 +==== e( 9) = 2.25759 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 16]+0.051*[# 30] + +0.051*[# 31]+0.051*[# 32]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + |psi|^2 = 0.994 +==== e( 10) = 2.25771 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.064*[# 2]+0.064*[# 3] + +0.064*[# 4]+0.057*[# 10]+0.057*[# 11]+0.057*[# 12]+0.057*[# 18] + +0.057*[# 19]+0.057*[# 20]+0.057*[# 22]+0.057*[# 23]+0.057*[# 24] + +0.057*[# 26]+0.057*[# 27]+0.057*[# 28] + |psi|^2 = 1.072 +==== e( 11) = 2.64326 eV ==== + psi = 0.110*[# 1]+0.055*[# 9]+0.055*[# 17]+0.055*[# 21]+0.055*[# 25] + +0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18]+0.048*[# 19] + +0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26] + +0.048*[# 27]+0.048*[# 28]+0.045*[# 6]+0.045*[# 8]+0.045*[# 14] + +0.045*[# 15]+0.045*[# 31]+0.045*[# 32]+0.037*[# 5]+0.037*[# 13] + +0.037*[# 29] + |psi|^2 = 1.291 +==== e( 12) = 2.64358 eV ==== + psi = 0.109*[# 2]+0.109*[# 3]+0.109*[# 4]+0.074*[# 5]+0.074*[# 13] + +0.074*[# 29]+0.055*[# 9]+0.055*[# 17]+0.055*[# 21]+0.055*[# 25] + +0.045*[# 7]+0.045*[# 16]+0.045*[# 30]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.023*[# 10] + +0.023*[# 11]+0.023*[# 12]+0.023*[# 18]+0.023*[# 19]+0.023*[# 20] + +0.023*[# 22]+0.023*[# 23]+0.023*[# 24]+0.023*[# 26]+0.023*[# 27] + +0.023*[# 28] + |psi|^2 = 1.369 +==== e( 13) = 4.25697 eV ==== + psi = 0.082*[# 7]+0.082*[# 16]+0.082*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14]+0.041*[# 15] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.041*[# 31] + +0.041*[# 32] + |psi|^2 = 0.990 +==== e( 14) = 4.25697 eV ==== + psi = 0.053*[# 7]+0.053*[# 16]+0.053*[# 30]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28] + |psi|^2 = 0.505 +==== e( 15) = 4.25808 eV ==== + psi = 0.062*[# 10]+0.062*[# 11]+0.062*[# 12]+0.062*[# 18]+0.062*[# 19] + +0.062*[# 20]+0.062*[# 22]+0.062*[# 23]+0.062*[# 24]+0.062*[# 26] + +0.062*[# 27]+0.062*[# 28]+0.030*[# 7]+0.030*[# 16]+0.030*[# 30] + +0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15]+0.017*[# 31] + +0.017*[# 32]+0.004*[# 2]+0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.949 +==== e( 16) = 4.25808 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.039*[# 6]+0.039*[# 8] + +0.039*[# 14]+0.039*[# 15]+0.039*[# 31]+0.039*[# 32]+0.005*[# 10] + +0.005*[# 11]+0.005*[# 12]+0.005*[# 18]+0.005*[# 19]+0.005*[# 20] + +0.005*[# 22]+0.005*[# 23]+0.005*[# 24]+0.005*[# 26]+0.005*[# 27] + +0.005*[# 28] + |psi|^2 = 0.526 + + k = 0.6666666667 0.0000000000 0.0000000000 +==== e( 1) = -5.34348 eV ==== + psi = 0.103*[# 5]+0.103*[# 9]+0.103*[# 13]+0.103*[# 17]+0.103*[# 21] + +0.103*[# 25]+0.103*[# 29]+0.103*[# 1]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4]+0.007*[# 6]+0.007*[# 7]+0.007*[# 8]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 14]+0.007*[# 15]+0.007*[# 16] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.007*[# 30] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.91783 eV ==== + psi = 0.082*[# 1]+0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.082*[# 29]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 7]+0.021*[# 8]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 14]+0.021*[# 15]+0.021*[# 16] + +0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23] + +0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.021*[# 30] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.163 +==== e( 3) = -1.54469 eV ==== + psi = 0.152*[# 9]+0.152*[# 17]+0.152*[# 21]+0.152*[# 25]+0.032*[# 7] + +0.032*[# 16]+0.032*[# 30]+0.023*[# 6]+0.023*[# 8]+0.023*[# 14] + +0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4] + |psi|^2 = 0.881 +==== e( 4) = -1.54469 eV ==== + psi = 0.152*[# 9]+0.152*[# 17]+0.152*[# 21]+0.152*[# 25]+0.033*[# 2] + +0.033*[# 3]+0.033*[# 4]+0.023*[# 6]+0.023*[# 8]+0.023*[# 14] + +0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12]+0.014*[# 18] + +0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24] + +0.014*[# 26]+0.014*[# 27]+0.014*[# 28] + |psi|^2 = 1.057 +==== e( 5) = -1.54458 eV ==== + psi = 0.202*[# 5]+0.202*[# 13]+0.202*[# 29]+0.032*[# 10]+0.032*[# 11] + +0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22] + +0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + + |psi|^2 = 0.994 +==== e( 6) = -1.54312 eV ==== + psi = 0.304*[# 1]+0.101*[# 5]+0.101*[# 13]+0.101*[# 29]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28] + |psi|^2 = 0.802 +==== e( 7) = 1.14721 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 6]+0.020*[# 7] + +0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.184 +==== e( 8) = 2.47079 eV ==== + psi = 0.066*[# 6]+0.066*[# 8]+0.066*[# 14]+0.066*[# 15]+0.066*[# 31] + +0.066*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.003*[# 5]+0.003*[# 13] + +0.003*[# 29] + |psi|^2 = 0.700 +==== e( 9) = 2.47096 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 6]+0.049*[# 7] + +0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 16]+0.049*[# 30] + +0.049*[# 31]+0.049*[# 32]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.002*[# 9] + +0.002*[# 17]+0.002*[# 21]+0.002*[# 25] + |psi|^2 = 0.994 +==== e( 10) = 2.47096 eV ==== + psi = 0.066*[# 10]+0.066*[# 11]+0.066*[# 12]+0.066*[# 18]+0.066*[# 19] + +0.066*[# 20]+0.066*[# 22]+0.066*[# 23]+0.066*[# 24]+0.066*[# 26] + +0.066*[# 27]+0.066*[# 28]+0.048*[# 7]+0.048*[# 16]+0.048*[# 30] + +0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31] + +0.027*[# 32]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.002*[# 9] + +0.002*[# 17]+0.002*[# 21]+0.002*[# 25] + |psi|^2 = 1.131 +==== e( 11) = 2.47113 eV ==== + psi = 0.109*[# 2]+0.109*[# 3]+0.109*[# 4]+0.067*[# 7]+0.067*[# 16] + +0.067*[# 30]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.004*[# 1] + +0.002*[# 5]+0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.960 +==== e( 12) = 3.72629 eV ==== + psi = 0.069*[# 10]+0.069*[# 11]+0.069*[# 12]+0.069*[# 18]+0.069*[# 19] + +0.069*[# 20]+0.069*[# 22]+0.069*[# 23]+0.069*[# 24]+0.069*[# 26] + +0.069*[# 27]+0.069*[# 28]+0.002*[# 2]+0.002*[# 3]+0.002*[# 4] + +0.002*[# 6]+0.002*[# 7]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15] + +0.002*[# 16]+0.002*[# 30]+0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.859 +==== e( 13) = 3.72629 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.993 +==== e( 14) = 4.12437 eV ==== + psi = 0.043*[# 1]+0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17] + +0.043*[# 21]+0.043*[# 25]+0.043*[# 29]+0.026*[# 2]+0.026*[# 3] + +0.026*[# 4]+0.026*[# 6]+0.026*[# 7]+0.026*[# 8]+0.026*[# 10] + +0.026*[# 11]+0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 16] + +0.026*[# 18]+0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23] + +0.026*[# 24]+0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.026*[# 30] + +0.026*[# 31]+0.026*[# 32] + |psi|^2 = 0.979 +==== e( 15) = 4.96156 eV ==== + psi = 0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18]+0.038*[# 19] + +0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26] + +0.038*[# 27]+0.038*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + +0.006*[# 6]+0.006*[# 7]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15] + +0.006*[# 16]+0.006*[# 30]+0.006*[# 31]+0.006*[# 32] + |psi|^2 = 0.523 +==== e( 16) = 4.96156 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.061*[# 6]+0.061*[# 7] + +0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 16]+0.061*[# 30] + +0.061*[# 31]+0.061*[# 32]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28] + |psi|^2 = 1.095 + + k = 0.8333333333 0.0000000000 0.0000000000 +==== e( 1) = -5.70745 eV ==== + psi = 0.117*[# 5]+0.117*[# 9]+0.117*[# 13]+0.117*[# 17]+0.117*[# 21] + +0.117*[# 25]+0.117*[# 29]+0.117*[# 1]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.002*[# 6]+0.002*[# 7]+0.002*[# 8]+0.002*[# 10] + +0.002*[# 11]+0.002*[# 12]+0.002*[# 14]+0.002*[# 15]+0.002*[# 16] + +0.002*[# 18]+0.002*[# 19]+0.002*[# 20]+0.002*[# 22]+0.002*[# 23] + +0.002*[# 24]+0.002*[# 26]+0.002*[# 27]+0.002*[# 28]+0.002*[# 30] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.88416 eV ==== + psi = 0.077*[# 5]+0.077*[# 9]+0.077*[# 13]+0.077*[# 17]+0.077*[# 21] + +0.077*[# 25]+0.077*[# 29]+0.076*[# 1]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 1.050 +==== e( 3) = -1.62947 eV ==== + psi = 0.147*[# 9]+0.147*[# 17]+0.147*[# 21]+0.147*[# 25]+0.030*[# 2] + +0.030*[# 3]+0.030*[# 4]+0.029*[# 6]+0.029*[# 8]+0.029*[# 14] + +0.029*[# 15]+0.029*[# 31]+0.029*[# 32]+0.029*[# 7]+0.029*[# 16] + +0.029*[# 30] + |psi|^2 = 0.940 +==== e( 4) = -1.62947 eV ==== + psi = 0.147*[# 9]+0.147*[# 17]+0.147*[# 21]+0.147*[# 25]+0.021*[# 7] + +0.021*[# 16]+0.021*[# 30]+0.020*[# 6]+0.020*[# 8]+0.020*[# 14] + +0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 18] + +0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23]+0.016*[# 24] + +0.016*[# 26]+0.016*[# 27]+0.016*[# 28] + |psi|^2 = 1.021 +==== e( 5) = -1.62936 eV ==== + psi = 0.196*[# 5]+0.196*[# 13]+0.196*[# 29]+0.034*[# 10]+0.034*[# 11] + +0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22] + +0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28] + + |psi|^2 = 0.993 +==== e( 6) = -1.62795 eV ==== + psi = 0.294*[# 1]+0.098*[# 5]+0.098*[# 13]+0.098*[# 29]+0.017*[# 10] + +0.017*[# 11]+0.017*[# 12]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20] + +0.017*[# 22]+0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27] + +0.017*[# 28] + |psi|^2 = 0.791 +==== e( 7) = -0.30800 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 9]+0.068*[# 13]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.068*[# 29]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.019*[# 2]+0.019*[# 3]+0.019*[# 4]+0.019*[# 6]+0.019*[# 7] + +0.019*[# 8]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.195 +==== e( 8) = 2.97062 eV ==== + psi = 0.075*[# 6]+0.075*[# 8]+0.075*[# 14]+0.075*[# 15]+0.075*[# 31] + +0.075*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.004*[# 5]+0.004*[# 13] + +0.004*[# 29] + |psi|^2 = 0.727 +==== e( 9) = 2.97089 eV ==== + psi = 0.045*[# 6]+0.045*[# 8]+0.045*[# 14]+0.045*[# 15]+0.045*[# 31] + +0.045*[# 32]+0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.044*[# 7] + +0.044*[# 16]+0.044*[# 30]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.003*[# 9] + +0.003*[# 17]+0.003*[# 21]+0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.97089 eV ==== + psi = 0.075*[# 10]+0.075*[# 11]+0.075*[# 12]+0.075*[# 18]+0.075*[# 19] + +0.075*[# 20]+0.075*[# 22]+0.075*[# 23]+0.075*[# 24]+0.075*[# 26] + +0.075*[# 27]+0.075*[# 28]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15]+0.010*[# 31] + +0.010*[# 32]+0.008*[# 7]+0.008*[# 16]+0.008*[# 30]+0.003*[# 9] + +0.003*[# 17]+0.003*[# 21]+0.003*[# 25] + |psi|^2 = 1.021 +==== e( 11) = 2.97118 eV ==== + psi = 0.111*[# 7]+0.111*[# 16]+0.111*[# 30]+0.107*[# 2]+0.107*[# 3] + +0.107*[# 4]+0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15] + +0.035*[# 31]+0.035*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12] + +0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23] + +0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 1] + +0.002*[# 5]+0.002*[# 13]+0.002*[# 29] + |psi|^2 = 1.146 +==== e( 12) = 3.39927 eV ==== + psi = 0.055*[# 10]+0.055*[# 11]+0.055*[# 12]+0.055*[# 18]+0.055*[# 19] + +0.055*[# 20]+0.055*[# 22]+0.055*[# 23]+0.055*[# 24]+0.055*[# 26] + +0.055*[# 27]+0.055*[# 28]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.023*[# 6]+0.023*[# 7]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15] + +0.023*[# 16]+0.023*[# 30]+0.023*[# 31]+0.023*[# 32] + |psi|^2 = 0.933 +==== e( 13) = 3.39927 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 5.47279 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32]+0.022*[# 1] + +0.022*[# 5]+0.022*[# 9]+0.022*[# 13]+0.022*[# 17]+0.022*[# 21] + +0.022*[# 25]+0.022*[# 29] + |psi|^2 = 0.969 +==== e( 15) = 5.73469 eV ==== + psi = 0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.039*[# 6]+0.039*[# 7] + +0.039*[# 8]+0.039*[# 14]+0.039*[# 15]+0.039*[# 16]+0.039*[# 30] + +0.039*[# 31]+0.039*[# 32]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12] + +0.025*[# 18]+0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23] + +0.025*[# 24]+0.025*[# 26]+0.025*[# 27]+0.025*[# 28] + |psi|^2 = 0.773 +==== e( 16) = 5.73469 eV ==== + psi = 0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18]+0.048*[# 19] + +0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26] + +0.048*[# 27]+0.048*[# 28]+0.034*[# 2]+0.034*[# 3]+0.034*[# 4] + +0.034*[# 6]+0.034*[# 7]+0.034*[# 8]+0.034*[# 14]+0.034*[# 15] + +0.034*[# 16]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32] + |psi|^2 = 0.993 + + k = 0.0000000000 0.1666666667 0.0000000000 +==== e( 1) = -5.70745 eV ==== + psi = 0.117*[# 5]+0.117*[# 9]+0.117*[# 13]+0.117*[# 17]+0.117*[# 21] + +0.117*[# 25]+0.117*[# 29]+0.117*[# 1]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.002*[# 6]+0.002*[# 7]+0.002*[# 8]+0.002*[# 10] + +0.002*[# 11]+0.002*[# 12]+0.002*[# 14]+0.002*[# 15]+0.002*[# 16] + +0.002*[# 18]+0.002*[# 19]+0.002*[# 20]+0.002*[# 22]+0.002*[# 23] + +0.002*[# 24]+0.002*[# 26]+0.002*[# 27]+0.002*[# 28]+0.002*[# 30] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.88416 eV ==== + psi = 0.077*[# 5]+0.077*[# 9]+0.077*[# 13]+0.077*[# 17]+0.077*[# 21] + +0.077*[# 25]+0.077*[# 29]+0.076*[# 1]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.016*[# 6]+0.016*[# 7]+0.016*[# 8]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 14]+0.016*[# 15]+0.016*[# 16] + +0.016*[# 18]+0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23] + +0.016*[# 24]+0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.016*[# 30] + +0.016*[# 31]+0.016*[# 32] + |psi|^2 = 0.993 +==== e( 3) = -1.62947 eV ==== + psi = 0.147*[# 9]+0.147*[# 17]+0.147*[# 21]+0.147*[# 25]+0.017*[# 7] + +0.017*[# 16]+0.017*[# 30]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14] + +0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4] + |psi|^2 = 0.724 +==== e( 4) = -1.62947 eV ==== + psi = 0.147*[# 9]+0.147*[# 17]+0.147*[# 21]+0.147*[# 25]+0.028*[# 2] + +0.028*[# 3]+0.028*[# 4]+0.022*[# 6]+0.022*[# 8]+0.022*[# 14] + +0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.017*[# 7]+0.017*[# 16] + +0.017*[# 30] + |psi|^2 = 0.858 +==== e( 5) = -1.62936 eV ==== + psi = 0.196*[# 5]+0.196*[# 13]+0.196*[# 29]+0.034*[# 10]+0.034*[# 11] + +0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22] + +0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28] + + |psi|^2 = 0.993 +==== e( 6) = -1.62795 eV ==== + psi = 0.294*[# 1]+0.098*[# 5]+0.098*[# 13]+0.098*[# 29]+0.034*[# 10] + +0.034*[# 11]+0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28] + |psi|^2 = 0.993 +==== e( 7) = -0.30800 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 9]+0.068*[# 13]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.068*[# 29]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.019*[# 2]+0.019*[# 3]+0.019*[# 4]+0.019*[# 6]+0.019*[# 7] + +0.019*[# 8]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.195 +==== e( 8) = 2.97062 eV ==== + psi = 0.075*[# 6]+0.075*[# 8]+0.075*[# 14]+0.075*[# 15]+0.075*[# 31] + +0.075*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.004*[# 5]+0.004*[# 13] + +0.004*[# 29] + |psi|^2 = 0.929 +==== e( 9) = 2.97089 eV ==== + psi = 0.045*[# 6]+0.045*[# 8]+0.045*[# 14]+0.045*[# 15]+0.045*[# 31] + +0.045*[# 32]+0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.044*[# 7] + +0.044*[# 16]+0.044*[# 30]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.003*[# 9] + +0.003*[# 17]+0.003*[# 21]+0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.97089 eV ==== + psi = 0.044*[# 6]+0.044*[# 7]+0.044*[# 8]+0.044*[# 14]+0.044*[# 15] + +0.044*[# 16]+0.044*[# 30]+0.044*[# 31]+0.044*[# 32]+0.044*[# 2] + +0.044*[# 3]+0.044*[# 4]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.003*[# 9] + +0.003*[# 17]+0.003*[# 21]+0.003*[# 25] + |psi|^2 = 0.993 +==== e( 11) = 2.97118 eV ==== + psi = 0.110*[# 2]+0.110*[# 3]+0.110*[# 4]+0.088*[# 7]+0.088*[# 16] + +0.088*[# 30]+0.024*[# 6]+0.024*[# 8]+0.024*[# 14]+0.024*[# 15] + +0.024*[# 31]+0.024*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12] + +0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23] + +0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 1] + +0.002*[# 5]+0.002*[# 13]+0.002*[# 29] + |psi|^2 = 1.018 +==== e( 12) = 3.39927 eV ==== + psi = 0.056*[# 7]+0.056*[# 16]+0.056*[# 30]+0.045*[# 6]+0.045*[# 8] + +0.045*[# 14]+0.045*[# 15]+0.045*[# 31]+0.045*[# 32]+0.034*[# 2] + +0.034*[# 3]+0.034*[# 4]+0.019*[# 10]+0.019*[# 11]+0.019*[# 12] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28] + |psi|^2 = 0.769 +==== e( 13) = 3.39927 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 5.47279 eV ==== + psi = 0.056*[# 10]+0.056*[# 11]+0.056*[# 12]+0.056*[# 18]+0.056*[# 19] + +0.056*[# 20]+0.056*[# 22]+0.056*[# 23]+0.056*[# 24]+0.056*[# 26] + +0.056*[# 27]+0.056*[# 28]+0.049*[# 2]+0.049*[# 3]+0.049*[# 4] + +0.049*[# 6]+0.049*[# 7]+0.049*[# 8]+0.049*[# 14]+0.049*[# 15] + +0.049*[# 16]+0.049*[# 30]+0.049*[# 31]+0.049*[# 32]+0.022*[# 1] + +0.022*[# 5]+0.022*[# 9]+0.022*[# 13]+0.022*[# 17]+0.022*[# 21] + +0.022*[# 25]+0.022*[# 29] + |psi|^2 = 1.437 +==== e( 15) = 5.73469 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 14]+0.038*[# 15]+0.038*[# 16]+0.038*[# 30] + +0.038*[# 31]+0.038*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28] + |psi|^2 = 0.618 +==== e( 16) = 5.73469 eV ==== + psi = 0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19] + +0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26] + +0.027*[# 27]+0.027*[# 28]+0.002*[# 2]+0.002*[# 3]+0.002*[# 4] + +0.002*[# 6]+0.002*[# 7]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15] + +0.002*[# 16]+0.002*[# 30]+0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.355 + + k = 0.1666666667 0.1666666667 0.0000000000 +==== e( 1) = -5.58652 eV ==== + psi = 0.112*[# 5]+0.112*[# 9]+0.112*[# 13]+0.112*[# 17]+0.112*[# 21] + +0.112*[# 25]+0.112*[# 29]+0.111*[# 1]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.80598 eV ==== + psi = 0.103*[# 5]+0.103*[# 13]+0.103*[# 29]+0.077*[# 9]+0.077*[# 17] + +0.077*[# 21]+0.077*[# 25]+0.021*[# 2]+0.021*[# 3]+0.021*[# 4] + +0.017*[# 6]+0.017*[# 8]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20] + +0.017*[# 22]+0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27] + +0.017*[# 28]+0.017*[# 31]+0.017*[# 32]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30] + |psi|^2 = 1.033 +==== e( 3) = -2.80522 eV ==== + psi = 0.155*[# 1]+0.077*[# 9]+0.077*[# 17]+0.077*[# 21]+0.077*[# 25] + +0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.016*[# 6]+0.016*[# 8]+0.016*[# 14]+0.016*[# 15] + +0.016*[# 31]+0.016*[# 32]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 18]+0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23] + +0.016*[# 24]+0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.012*[# 2] + +0.012*[# 3]+0.012*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -1.80516 eV ==== + psi = 0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25]+0.079*[# 1] + +0.079*[# 5]+0.079*[# 13]+0.079*[# 29]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19]+0.009*[# 20] + +0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26]+0.009*[# 27] + +0.009*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.848 +==== e( 5) = -1.40568 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 13]+0.070*[# 29]+0.069*[# 9] + +0.069*[# 17]+0.069*[# 21]+0.069*[# 25]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.34433 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + +0.018*[# 6]+0.018*[# 8]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20] + +0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27] + +0.018*[# 28]+0.018*[# 31]+0.018*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.981 +==== e( 7) = -0.34382 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.019*[# 7] + +0.019*[# 16]+0.019*[# 30]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.014*[# 2] + +0.014*[# 3]+0.014*[# 4] + |psi|^2 = 0.993 +==== e( 8) = 2.26764 eV ==== + psi = 0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.043*[# 7]+0.043*[# 16] + +0.043*[# 30]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 1.014 +==== e( 9) = 3.00585 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 3.00589 eV ==== + psi = 0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.030*[# 10]+0.030*[# 11] + +0.030*[# 12]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22] + +0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28] + +0.023*[# 2]+0.023*[# 3]+0.023*[# 4]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.007*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.743 +==== e( 11) = 3.20562 eV ==== + psi = 0.081*[# 7]+0.081*[# 16]+0.081*[# 30]+0.048*[# 2]+0.048*[# 3] + +0.048*[# 4]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32] + |psi|^2 = 1.056 +==== e( 12) = 3.20630 eV ==== + psi = 0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.034*[# 10] + +0.034*[# 11]+0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30] + |psi|^2 = 0.807 +==== e( 13) = 3.48375 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 4.56822 eV ==== + psi = 0.047*[# 2]+0.047*[# 3]+0.047*[# 4]+0.047*[# 6]+0.047*[# 7] + +0.047*[# 8]+0.047*[# 10]+0.047*[# 11]+0.047*[# 12]+0.047*[# 14] + +0.047*[# 15]+0.047*[# 16]+0.047*[# 18]+0.047*[# 19]+0.047*[# 20] + +0.047*[# 22]+0.047*[# 23]+0.047*[# 24]+0.047*[# 26]+0.047*[# 27] + +0.047*[# 28]+0.047*[# 30]+0.047*[# 31]+0.047*[# 32]+0.026*[# 1] + +0.026*[# 5]+0.026*[# 9]+0.026*[# 13]+0.026*[# 17]+0.026*[# 21] + +0.026*[# 25]+0.026*[# 29] + |psi|^2 = 1.332 +==== e( 15) = 5.28998 eV ==== + psi = 0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.016*[# 6]+0.016*[# 7] + +0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 14] + +0.016*[# 15]+0.016*[# 16]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 30]+0.016*[# 31]+0.016*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.418 +==== e( 16) = 6.05492 eV ==== + psi = 0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.053*[# 6]+0.054*[# 7] + +0.053*[# 8]+0.054*[# 10]+0.054*[# 11]+0.054*[# 12]+0.053*[# 14] + +0.053*[# 15]+0.054*[# 16]+0.054*[# 18]+0.054*[# 19]+0.054*[# 20] + +0.054*[# 22]+0.054*[# 23]+0.054*[# 24]+0.054*[# 26]+0.054*[# 27] + +0.054*[# 28]+0.054*[# 30]+0.053*[# 31]+0.053*[# 32] + |psi|^2 = 1.285 + + k = 0.3333333333 0.1666666667 0.0000000000 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.141 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.955 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 1.088 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 0.887 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 6]+0.023*[# 7]+0.023*[# 8]+0.023*[# 10] + +0.023*[# 11]+0.023*[# 12]+0.023*[# 14]+0.023*[# 15]+0.023*[# 16] + +0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23] + +0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.023*[# 30] + +0.023*[# 31]+0.023*[# 32] + |psi|^2 = 1.058 +==== e( 8) = 1.85450 eV ==== + psi = 0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.029*[# 6]+0.029*[# 7] + +0.029*[# 8]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14] + +0.029*[# 15]+0.029*[# 16]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.029*[# 30]+0.029*[# 31]+0.029*[# 32] + |psi|^2 = 0.707 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.043*[# 7]+0.043*[# 2]+0.043*[# 4]+0.043*[# 6]+0.043*[# 3] + +0.043*[# 8]+0.043*[# 16]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 18]+0.043*[# 19]+0.043*[# 20] + +0.043*[# 22]+0.043*[# 23]+0.043*[# 24]+0.043*[# 26]+0.043*[# 27] + +0.043*[# 28]+0.043*[# 30]+0.043*[# 31]+0.043*[# 32] + |psi|^2 = 1.024 +==== e( 11) = 3.29155 eV ==== + psi = 0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.032*[# 7]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12] + +0.032*[# 16]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22] + +0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + +0.032*[# 30]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.802 +==== e( 12) = 3.36033 eV ==== + psi = 0.056*[# 2]+0.056*[# 3]+0.056*[# 4]+0.056*[# 7]+0.056*[# 16] + +0.056*[# 30]+0.056*[# 10]+0.056*[# 11]+0.056*[# 12]+0.056*[# 18] + +0.056*[# 19]+0.056*[# 20]+0.056*[# 22]+0.056*[# 23]+0.056*[# 24] + +0.056*[# 26]+0.056*[# 27]+0.056*[# 28]+0.055*[# 6]+0.055*[# 8] + +0.055*[# 14]+0.055*[# 15]+0.055*[# 31]+0.055*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 1.346 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.984 +==== e( 15) = 4.50839 eV ==== + psi = 0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.029*[# 6]+0.029*[# 7] + +0.029*[# 8]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14] + +0.029*[# 15]+0.029*[# 16]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.029*[# 30]+0.029*[# 31]+0.029*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.743 +==== e( 16) = 5.45761 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.991 + + k = 0.5000000000 0.1666666667 0.0000000000 +==== e( 1) = -4.63271 eV ==== + psi = 0.120*[# 5]+0.120*[# 13]+0.120*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.001*[# 6]+0.001*[# 8]+0.001*[# 14]+0.001*[# 15]+0.001*[# 31] + +0.001*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.63166 eV ==== + psi = 0.180*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.023*[# 2] + +0.023*[# 3]+0.023*[# 4]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12] + +0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23] + +0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + |psi|^2 = 1.239 +==== e( 3) = -2.29294 eV ==== + psi = 0.110*[# 5]+0.110*[# 13]+0.110*[# 29]+0.082*[# 9]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.883 +==== e( 4) = -2.29202 eV ==== + psi = 0.164*[# 1]+0.082*[# 9]+0.082*[# 17]+0.082*[# 21]+0.082*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.017*[# 2] + +0.017*[# 3]+0.017*[# 4] + |psi|^2 = 1.128 +==== e( 5) = -0.76680 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19] + +0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26] + +0.018*[# 27]+0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.994 +==== e( 6) = -0.76629 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28] + |psi|^2 = 0.759 +==== e( 7) = 1.89706 eV ==== + psi = 0.049*[# 6]+0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 31] + +0.049*[# 32]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.003*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.858 +==== e( 8) = 1.89734 eV ==== + psi = 0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.011*[# 6]+0.011*[# 8] + +0.011*[# 14]+0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.623 +==== e( 9) = 2.23554 eV ==== + psi = 0.103*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15]+0.040*[# 31] + +0.040*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.987 +==== e( 10) = 2.23572 eV ==== + psi = 0.070*[# 7]+0.070*[# 16]+0.070*[# 30]+0.069*[# 5]+0.069*[# 13] + +0.069*[# 29]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19] + +0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26] + +0.035*[# 27]+0.035*[# 28]+0.032*[# 2]+0.032*[# 3]+0.032*[# 4] + +0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15]+0.019*[# 31] + +0.019*[# 32] + |psi|^2 = 1.258 +==== e( 11) = 3.04468 eV ==== + psi = 0.066*[# 7]+0.066*[# 16]+0.066*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.910 +==== e( 12) = 3.04476 eV ==== + psi = 0.066*[# 6]+0.066*[# 8]+0.066*[# 14]+0.066*[# 15]+0.066*[# 31] + +0.066*[# 32]+0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.049*[# 10] + +0.049*[# 11]+0.049*[# 12]+0.049*[# 18]+0.049*[# 19]+0.049*[# 20] + +0.049*[# 22]+0.049*[# 23]+0.049*[# 24]+0.049*[# 26]+0.049*[# 27] + +0.049*[# 28]+0.002*[# 1]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 1.181 +==== e( 13) = 3.80535 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.989 +==== e( 14) = 3.80571 eV ==== + psi = 0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.020*[# 10]+0.020*[# 11] + +0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22] + +0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28] + +0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15]+0.017*[# 31] + +0.017*[# 32]+0.008*[# 5]+0.008*[# 13]+0.008*[# 29]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.520 +==== e( 15) = 4.52337 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.060*[# 7]+0.060*[# 16] + +0.060*[# 30]+0.053*[# 10]+0.053*[# 11]+0.053*[# 12]+0.053*[# 18] + +0.053*[# 19]+0.053*[# 20]+0.053*[# 22]+0.053*[# 23]+0.053*[# 24] + +0.053*[# 26]+0.053*[# 27]+0.053*[# 28]+0.044*[# 6]+0.044*[# 8] + +0.044*[# 14]+0.044*[# 15]+0.044*[# 31]+0.044*[# 32]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 1.284 +==== e( 16) = 4.52360 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.033*[# 10] + +0.033*[# 11]+0.033*[# 12]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.006*[# 1]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.002*[# 5]+0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.815 + + k = 0.6666666667 0.1666666667 0.0000000000 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.141 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.955 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 1.088 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 0.887 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 6]+0.023*[# 7]+0.023*[# 8]+0.023*[# 10] + +0.023*[# 11]+0.023*[# 12]+0.023*[# 14]+0.023*[# 15]+0.023*[# 16] + +0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23] + +0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.023*[# 30] + +0.023*[# 31]+0.023*[# 32] + |psi|^2 = 1.058 +==== e( 8) = 1.85450 eV ==== + psi = 0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.029*[# 6]+0.029*[# 7] + +0.029*[# 8]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14] + +0.029*[# 15]+0.029*[# 16]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.029*[# 30]+0.029*[# 31]+0.029*[# 32] + |psi|^2 = 0.707 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.043*[# 7]+0.043*[# 2]+0.043*[# 4]+0.043*[# 6]+0.043*[# 3] + +0.043*[# 8]+0.043*[# 16]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 18]+0.043*[# 19]+0.043*[# 20] + +0.043*[# 22]+0.043*[# 23]+0.043*[# 24]+0.043*[# 26]+0.043*[# 27] + +0.043*[# 28]+0.043*[# 30]+0.043*[# 31]+0.043*[# 32] + |psi|^2 = 1.024 +==== e( 11) = 3.29155 eV ==== + psi = 0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.032*[# 7]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12] + +0.032*[# 16]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22] + +0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + +0.032*[# 30]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.802 +==== e( 12) = 3.36033 eV ==== + psi = 0.056*[# 2]+0.056*[# 3]+0.056*[# 4]+0.056*[# 7]+0.056*[# 16] + +0.056*[# 30]+0.056*[# 10]+0.056*[# 11]+0.056*[# 12]+0.056*[# 18] + +0.056*[# 19]+0.056*[# 20]+0.056*[# 22]+0.056*[# 23]+0.056*[# 24] + +0.056*[# 26]+0.056*[# 27]+0.056*[# 28]+0.055*[# 6]+0.055*[# 8] + +0.055*[# 14]+0.055*[# 15]+0.055*[# 31]+0.055*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 1.346 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.984 +==== e( 15) = 4.50839 eV ==== + psi = 0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.029*[# 6]+0.029*[# 7] + +0.029*[# 8]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14] + +0.029*[# 15]+0.029*[# 16]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.029*[# 30]+0.029*[# 31]+0.029*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.743 +==== e( 16) = 5.45761 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.991 + + k = 0.8333333333 0.1666666667 0.0000000000 +==== e( 1) = -5.58652 eV ==== + psi = 0.112*[# 5]+0.112*[# 9]+0.112*[# 13]+0.112*[# 17]+0.112*[# 21] + +0.112*[# 25]+0.112*[# 29]+0.111*[# 1]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.80598 eV ==== + psi = 0.103*[# 5]+0.103*[# 13]+0.103*[# 29]+0.077*[# 9]+0.077*[# 17] + +0.077*[# 21]+0.077*[# 25]+0.021*[# 2]+0.021*[# 3]+0.021*[# 4] + +0.017*[# 6]+0.017*[# 8]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20] + +0.017*[# 22]+0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27] + +0.017*[# 28]+0.017*[# 31]+0.017*[# 32]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30] + |psi|^2 = 1.033 +==== e( 3) = -2.80522 eV ==== + psi = 0.155*[# 1]+0.077*[# 9]+0.077*[# 17]+0.077*[# 21]+0.077*[# 25] + +0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.016*[# 6]+0.016*[# 8]+0.016*[# 14]+0.016*[# 15] + +0.016*[# 31]+0.016*[# 32]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 18]+0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23] + +0.016*[# 24]+0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.012*[# 2] + +0.012*[# 3]+0.012*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -1.80516 eV ==== + psi = 0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25]+0.079*[# 1] + +0.079*[# 5]+0.079*[# 13]+0.079*[# 29]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19]+0.009*[# 20] + +0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26]+0.009*[# 27] + +0.009*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.848 +==== e( 5) = -1.40568 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 13]+0.070*[# 29]+0.069*[# 9] + +0.069*[# 17]+0.069*[# 21]+0.069*[# 25]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.34433 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + +0.018*[# 6]+0.018*[# 8]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20] + +0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27] + +0.018*[# 28]+0.018*[# 31]+0.018*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.981 +==== e( 7) = -0.34382 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.019*[# 7] + +0.019*[# 16]+0.019*[# 30]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.014*[# 2] + +0.014*[# 3]+0.014*[# 4] + |psi|^2 = 0.993 +==== e( 8) = 2.26764 eV ==== + psi = 0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.043*[# 7]+0.043*[# 16] + +0.043*[# 30]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 1.014 +==== e( 9) = 3.00585 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 3.00589 eV ==== + psi = 0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.030*[# 10]+0.030*[# 11] + +0.030*[# 12]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22] + +0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28] + +0.023*[# 2]+0.023*[# 3]+0.023*[# 4]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.007*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.743 +==== e( 11) = 3.20562 eV ==== + psi = 0.081*[# 7]+0.081*[# 16]+0.081*[# 30]+0.048*[# 2]+0.048*[# 3] + +0.048*[# 4]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32] + |psi|^2 = 1.056 +==== e( 12) = 3.20630 eV ==== + psi = 0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.034*[# 10] + +0.034*[# 11]+0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30] + |psi|^2 = 0.807 +==== e( 13) = 3.48375 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 4.56822 eV ==== + psi = 0.047*[# 2]+0.047*[# 3]+0.047*[# 4]+0.047*[# 6]+0.047*[# 7] + +0.047*[# 8]+0.047*[# 10]+0.047*[# 11]+0.047*[# 12]+0.047*[# 14] + +0.047*[# 15]+0.047*[# 16]+0.047*[# 18]+0.047*[# 19]+0.047*[# 20] + +0.047*[# 22]+0.047*[# 23]+0.047*[# 24]+0.047*[# 26]+0.047*[# 27] + +0.047*[# 28]+0.047*[# 30]+0.047*[# 31]+0.047*[# 32]+0.026*[# 1] + +0.026*[# 5]+0.026*[# 9]+0.026*[# 13]+0.026*[# 17]+0.026*[# 21] + +0.026*[# 25]+0.026*[# 29] + |psi|^2 = 1.332 +==== e( 15) = 5.28998 eV ==== + psi = 0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.016*[# 6]+0.016*[# 7] + +0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 14] + +0.016*[# 15]+0.016*[# 16]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 30]+0.016*[# 31]+0.016*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.418 +==== e( 16) = 6.05492 eV ==== + psi = 0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.053*[# 6]+0.054*[# 7] + +0.053*[# 8]+0.054*[# 10]+0.054*[# 11]+0.054*[# 12]+0.053*[# 14] + +0.053*[# 15]+0.054*[# 16]+0.054*[# 18]+0.054*[# 19]+0.054*[# 20] + +0.054*[# 22]+0.054*[# 23]+0.054*[# 24]+0.054*[# 26]+0.054*[# 27] + +0.054*[# 28]+0.054*[# 30]+0.053*[# 31]+0.053*[# 32] + |psi|^2 = 1.285 + + k = 0.0000000000 0.3333333333 0.0000000000 +==== e( 1) = -5.34348 eV ==== + psi = 0.103*[# 5]+0.103*[# 9]+0.103*[# 13]+0.103*[# 17]+0.103*[# 21] + +0.103*[# 25]+0.103*[# 29]+0.103*[# 1]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4]+0.007*[# 6]+0.007*[# 7]+0.007*[# 8]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 14]+0.007*[# 15]+0.007*[# 16] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.007*[# 30] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.91783 eV ==== + psi = 0.082*[# 1]+0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.082*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 0.993 +==== e( 3) = -1.54469 eV ==== + psi = 0.152*[# 9]+0.152*[# 17]+0.152*[# 21]+0.152*[# 25]+0.029*[# 2] + +0.029*[# 3]+0.029*[# 4]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.810 +==== e( 4) = -1.54469 eV ==== + psi = 0.152*[# 9]+0.152*[# 17]+0.152*[# 21]+0.152*[# 25]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14] + +0.015*[# 15]+0.015*[# 31]+0.015*[# 32]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4] + |psi|^2 = 0.792 +==== e( 5) = -1.54458 eV ==== + psi = 0.202*[# 5]+0.202*[# 13]+0.202*[# 29]+0.032*[# 10]+0.032*[# 11] + +0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22] + +0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + + |psi|^2 = 0.994 +==== e( 6) = -1.54312 eV ==== + psi = 0.304*[# 1]+0.101*[# 5]+0.101*[# 13]+0.101*[# 29]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28] + |psi|^2 = 0.994 +==== e( 7) = 1.14721 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 6]+0.020*[# 7] + +0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.184 +==== e( 8) = 2.47079 eV ==== + psi = 0.066*[# 6]+0.066*[# 8]+0.066*[# 14]+0.066*[# 15]+0.066*[# 31] + +0.066*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.003*[# 5]+0.003*[# 13] + +0.003*[# 29] + |psi|^2 = 0.893 +==== e( 9) = 2.47096 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 6]+0.049*[# 7] + +0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 16]+0.049*[# 30] + +0.049*[# 31]+0.049*[# 32]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.002*[# 9] + +0.002*[# 17]+0.002*[# 21]+0.002*[# 25] + |psi|^2 = 0.994 +==== e( 10) = 2.47096 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 6]+0.049*[# 7] + +0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 16]+0.049*[# 30] + +0.049*[# 31]+0.049*[# 32]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.002*[# 9] + +0.002*[# 17]+0.002*[# 21]+0.002*[# 25] + |psi|^2 = 0.993 +==== e( 11) = 2.47113 eV ==== + psi = 0.098*[# 2]+0.098*[# 3]+0.098*[# 4]+0.082*[# 7]+0.082*[# 16] + +0.082*[# 30]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.004*[# 1] + +0.002*[# 5]+0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.985 +==== e( 12) = 3.72629 eV ==== + psi = 0.042*[# 7]+0.042*[# 16]+0.042*[# 30]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.028*[# 10] + +0.028*[# 11]+0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + |psi|^2 = 0.749 +==== e( 13) = 3.72629 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.993 +==== e( 14) = 4.12437 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.059*[# 6]+0.059*[# 7] + +0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 16]+0.059*[# 30] + +0.059*[# 31]+0.059*[# 32]+0.043*[# 1]+0.043*[# 5]+0.043*[# 9] + +0.043*[# 13]+0.043*[# 17]+0.043*[# 21]+0.043*[# 25]+0.043*[# 29] + +0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18]+0.040*[# 19] + +0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26] + +0.040*[# 27]+0.040*[# 28] + |psi|^2 = 1.525 +==== e( 15) = 4.96156 eV ==== + psi = 0.025*[# 2]+0.025*[# 3]+0.025*[# 4]+0.025*[# 6]+0.025*[# 7] + +0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 16]+0.025*[# 30] + +0.025*[# 31]+0.025*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28] + |psi|^2 = 0.587 +==== e( 16) = 4.96156 eV ==== + psi = 0.017*[# 10]+0.017*[# 11]+0.017*[# 12]+0.017*[# 18]+0.017*[# 19] + +0.017*[# 20]+0.017*[# 22]+0.017*[# 23]+0.017*[# 24]+0.017*[# 26] + +0.017*[# 27]+0.017*[# 28]+0.016*[# 2]+0.016*[# 3]+0.016*[# 4] + +0.016*[# 6]+0.016*[# 7]+0.016*[# 8]+0.016*[# 14]+0.016*[# 15] + +0.016*[# 16]+0.016*[# 30]+0.016*[# 31]+0.016*[# 32] + |psi|^2 = 0.396 + + k = 0.1666666667 0.3333333333 0.0000000000 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 6]+0.015*[# 7]+0.015*[# 8]+0.015*[# 10] + +0.015*[# 11]+0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 16] + +0.015*[# 18]+0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23] + +0.015*[# 24]+0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.015*[# 30] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 1.023 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.955 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.005*[# 2]+0.005*[# 3] + +0.005*[# 4]+0.005*[# 6]+0.005*[# 7]+0.005*[# 8]+0.005*[# 10] + +0.005*[# 11]+0.005*[# 12]+0.005*[# 14]+0.005*[# 15]+0.005*[# 16] + +0.005*[# 18]+0.005*[# 19]+0.005*[# 20]+0.005*[# 22]+0.005*[# 23] + +0.005*[# 24]+0.005*[# 26]+0.005*[# 27]+0.005*[# 28]+0.005*[# 30] + +0.005*[# 31]+0.005*[# 32] + |psi|^2 = 0.784 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.016*[# 6]+0.016*[# 7]+0.016*[# 8]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 14]+0.016*[# 15]+0.016*[# 16] + +0.016*[# 18]+0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23] + +0.016*[# 24]+0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.016*[# 30] + +0.016*[# 31]+0.016*[# 32] + |psi|^2 = 0.935 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 6]+0.023*[# 7]+0.023*[# 8]+0.023*[# 10] + +0.023*[# 11]+0.023*[# 12]+0.023*[# 14]+0.023*[# 15]+0.023*[# 16] + +0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23] + +0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.023*[# 30] + +0.023*[# 31]+0.023*[# 32] + |psi|^2 = 1.058 +==== e( 8) = 1.85450 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.986 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.034*[# 7]+0.034*[# 2]+0.034*[# 4]+0.034*[# 6]+0.034*[# 3] + +0.034*[# 8]+0.034*[# 16]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32] + |psi|^2 = 0.826 +==== e( 11) = 3.29155 eV ==== + psi = 0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.032*[# 7]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12] + +0.032*[# 16]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22] + +0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + +0.032*[# 30]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.802 +==== e( 12) = 3.36033 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.048*[# 7]+0.048*[# 16] + +0.048*[# 30]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.048*[# 6]+0.048*[# 8] + +0.048*[# 14]+0.048*[# 15]+0.048*[# 31]+0.048*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 1.161 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.033*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.033*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.033*[# 30]+0.034*[# 31]+0.034*[# 32] + |psi|^2 = 0.808 +==== e( 15) = 4.50839 eV ==== + psi = 0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.029*[# 6]+0.029*[# 7] + +0.029*[# 8]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14] + +0.029*[# 15]+0.029*[# 16]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.029*[# 30]+0.029*[# 31]+0.029*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.743 +==== e( 16) = 5.45761 eV ==== + psi = 0.057*[# 2]+0.057*[# 3]+0.057*[# 4]+0.056*[# 6]+0.056*[# 7] + +0.056*[# 8]+0.056*[# 10]+0.056*[# 11]+0.056*[# 12]+0.056*[# 14] + +0.056*[# 15]+0.056*[# 16]+0.056*[# 18]+0.056*[# 19]+0.056*[# 20] + +0.056*[# 22]+0.056*[# 23]+0.056*[# 24]+0.056*[# 26]+0.056*[# 27] + +0.056*[# 28]+0.056*[# 30]+0.056*[# 31]+0.056*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.383 + + k = 0.3333333333 0.3333333333 0.0000000000 +==== e( 1) = -4.87592 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.52951 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.017*[# 6]+0.017*[# 8]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20] + +0.017*[# 22]+0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27] + +0.017*[# 28]+0.017*[# 31]+0.017*[# 32]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30] + |psi|^2 = 1.085 +==== e( 3) = -3.52873 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.004*[# 2] + +0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -2.54529 eV ==== + psi = 0.085*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.085*[# 5]+0.085*[# 13]+0.085*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 7]+0.018*[# 16]+0.018*[# 30]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 1.015 +==== e( 5) = -0.62188 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.994 +==== e( 6) = 0.50951 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.061*[# 9]+0.061*[# 17] + +0.061*[# 21]+0.061*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.875 +==== e( 7) = 0.50974 eV ==== + psi = 0.122*[# 1]+0.061*[# 9]+0.061*[# 17]+0.061*[# 21]+0.061*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.029*[# 6]+0.029*[# 8] + +0.029*[# 14]+0.029*[# 15]+0.029*[# 31]+0.029*[# 32]+0.023*[# 7] + +0.023*[# 16]+0.023*[# 30]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12] + +0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23] + +0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.992 +==== e( 8) = 1.69051 eV ==== + psi = 0.036*[# 2]+0.036*[# 3]+0.036*[# 4]+0.036*[# 7]+0.036*[# 16] + +0.036*[# 30]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 18] + +0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23]+0.031*[# 24] + +0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.002*[# 1] + +0.002*[# 5]+0.002*[# 9]+0.002*[# 13]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.002*[# 29] + |psi|^2 = 0.758 +==== e( 9) = 2.43371 eV ==== + psi = 0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17]+0.043*[# 21] + +0.043*[# 25]+0.043*[# 29]+0.043*[# 1]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 0.987 +==== e( 10) = 2.54749 eV ==== + psi = 0.045*[# 7]+0.045*[# 16]+0.045*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 14]+0.028*[# 15] + +0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23] + +0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.028*[# 31] + +0.028*[# 32]+0.015*[# 1]+0.010*[# 2]+0.010*[# 3]+0.010*[# 4] + +0.008*[# 9]+0.008*[# 17]+0.008*[# 21]+0.008*[# 25]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29] + |psi|^2 = 0.729 +==== e( 11) = 2.54759 eV ==== + psi = 0.077*[# 2]+0.077*[# 3]+0.077*[# 4]+0.041*[# 7]+0.041*[# 16] + +0.041*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29]+0.008*[# 9]+0.008*[# 17]+0.008*[# 21] + +0.008*[# 25] + |psi|^2 = 0.992 +==== e( 12) = 3.71718 eV ==== + psi = 0.034*[# 6]+0.034*[# 8]+0.034*[# 14]+0.034*[# 15]+0.034*[# 31] + +0.034*[# 32]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.016*[# 7]+0.016*[# 16] + +0.016*[# 30]+0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.680 +==== e( 13) = 3.84161 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 14]+0.050*[# 15]+0.050*[# 31]+0.050*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.002*[# 5]+0.002*[# 13]+0.002*[# 29]+0.001*[# 9] + +0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 3.84259 eV ==== + psi = 0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.063*[# 6]+0.063*[# 8] + +0.063*[# 14]+0.063*[# 15]+0.063*[# 31]+0.063*[# 32]+0.048*[# 10] + +0.048*[# 11]+0.048*[# 12]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.003*[# 1]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 5]+0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.158 +==== e( 15) = 4.03675 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.059*[# 7]+0.059*[# 16] + +0.059*[# 30]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 18] + +0.050*[# 19]+0.050*[# 20]+0.050*[# 22]+0.050*[# 23]+0.050*[# 24] + +0.050*[# 26]+0.050*[# 27]+0.050*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 1.206 +==== e( 16) = 5.60339 eV ==== + psi = 0.073*[# 2]+0.073*[# 3]+0.073*[# 4]+0.072*[# 7]+0.072*[# 16] + +0.072*[# 30]+0.057*[# 10]+0.057*[# 11]+0.057*[# 12]+0.057*[# 18] + +0.057*[# 19]+0.057*[# 20]+0.057*[# 22]+0.057*[# 23]+0.057*[# 24] + +0.057*[# 26]+0.057*[# 27]+0.057*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 1.364 + + k = 0.5000000000 0.3333333333 0.0000000000 +==== e( 1) = -4.30426 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.30321 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.023*[# 2] + +0.023*[# 3]+0.023*[# 4]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28] + |psi|^2 = 1.179 +==== e( 3) = -3.08338 eV ==== + psi = 0.113*[# 5]+0.113*[# 13]+0.113*[# 29]+0.084*[# 9]+0.084*[# 17] + +0.084*[# 21]+0.084*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.011*[# 10]+0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19] + +0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26] + +0.011*[# 27]+0.011*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4] + |psi|^2 = 0.944 +==== e( 4) = -3.08238 eV ==== + psi = 0.169*[# 1]+0.084*[# 9]+0.084*[# 17]+0.084*[# 21]+0.084*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 18]+0.019*[# 19]+0.019*[# 20] + +0.019*[# 22]+0.019*[# 23]+0.019*[# 24]+0.019*[# 26]+0.019*[# 27] + +0.019*[# 28]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30]+0.015*[# 2] + +0.015*[# 3]+0.015*[# 4] + |psi|^2 = 1.130 +==== e( 5) = -0.06735 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.060*[# 9]+0.060*[# 17] + +0.060*[# 21]+0.060*[# 25]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + +0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19] + +0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26] + +0.021*[# 27]+0.021*[# 28]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 16]+0.018*[# 30]+0.018*[# 31] + +0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.06705 eV ==== + psi = 0.121*[# 1]+0.060*[# 9]+0.060*[# 17]+0.060*[# 21]+0.060*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12] + +0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23] + +0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + |psi|^2 = 0.776 +==== e( 7) = 1.46284 eV ==== + psi = 0.102*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.037*[# 6]+0.037*[# 8]+0.037*[# 14]+0.037*[# 15]+0.037*[# 31] + +0.037*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20] + +0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27] + +0.027*[# 28]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30]+0.011*[# 2] + +0.011*[# 3]+0.011*[# 4] + |psi|^2 = 1.055 +==== e( 8) = 1.46285 eV ==== + psi = 0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.036*[# 7]+0.036*[# 16]+0.036*[# 30] + +0.019*[# 2]+0.019*[# 3]+0.019*[# 4]+0.018*[# 10]+0.018*[# 11] + +0.018*[# 12]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22] + +0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28] + +0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15]+0.008*[# 31] + +0.008*[# 32] + |psi|^2 = 0.838 +==== e( 9) = 1.95717 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 1.95751 eV ==== + psi = 0.065*[# 7]+0.065*[# 16]+0.065*[# 30]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22] + +0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28] + +0.024*[# 2]+0.024*[# 3]+0.024*[# 4]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.826 +==== e( 11) = 3.02286 eV ==== + psi = 0.058*[# 2]+0.058*[# 3]+0.058*[# 4]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.020*[# 1]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.007*[# 5]+0.007*[# 13]+0.007*[# 29] + |psi|^2 = 0.936 +==== e( 12) = 3.02323 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.034*[# 7]+0.034*[# 16] + +0.034*[# 30]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.013*[# 5] + +0.013*[# 13]+0.013*[# 29]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25] + |psi|^2 = 0.770 +==== e( 13) = 4.06622 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 4.06644 eV ==== + psi = 0.075*[# 2]+0.075*[# 3]+0.075*[# 4]+0.075*[# 6]+0.075*[# 8] + +0.075*[# 14]+0.075*[# 15]+0.075*[# 31]+0.075*[# 32]+0.056*[# 10] + +0.056*[# 11]+0.056*[# 12]+0.056*[# 18]+0.056*[# 19]+0.056*[# 20] + +0.056*[# 22]+0.056*[# 23]+0.056*[# 24]+0.056*[# 26]+0.056*[# 27] + +0.056*[# 28]+0.003*[# 1]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 1.357 +==== e( 15) = 4.88257 eV ==== + psi = 0.080*[# 7]+0.080*[# 16]+0.080*[# 30]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.978 +==== e( 16) = 4.88277 eV ==== + psi = 0.072*[# 6]+0.072*[# 8]+0.072*[# 14]+0.072*[# 15]+0.072*[# 31] + +0.072*[# 32]+0.055*[# 10]+0.055*[# 11]+0.055*[# 12]+0.055*[# 18] + +0.055*[# 19]+0.055*[# 20]+0.055*[# 22]+0.055*[# 23]+0.055*[# 24] + +0.055*[# 26]+0.055*[# 27]+0.055*[# 28]+0.040*[# 2]+0.040*[# 3] + +0.040*[# 4]+0.037*[# 7]+0.037*[# 16]+0.037*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.345 + + k = 0.6666666667 0.3333333333 0.0000000000 +==== e( 1) = -4.87592 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.52951 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.017*[# 6]+0.017*[# 8]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20] + +0.017*[# 22]+0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27] + +0.017*[# 28]+0.017*[# 31]+0.017*[# 32]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30] + |psi|^2 = 1.085 +==== e( 3) = -3.52873 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.004*[# 2] + +0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -2.54529 eV ==== + psi = 0.085*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.085*[# 5]+0.085*[# 13]+0.085*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 7]+0.018*[# 16]+0.018*[# 30]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 1.015 +==== e( 5) = -0.62188 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.994 +==== e( 6) = 0.50951 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.061*[# 9]+0.061*[# 17] + +0.061*[# 21]+0.061*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.875 +==== e( 7) = 0.50974 eV ==== + psi = 0.122*[# 1]+0.061*[# 9]+0.061*[# 17]+0.061*[# 21]+0.061*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.029*[# 6]+0.029*[# 8] + +0.029*[# 14]+0.029*[# 15]+0.029*[# 31]+0.029*[# 32]+0.023*[# 7] + +0.023*[# 16]+0.023*[# 30]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12] + +0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23] + +0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.992 +==== e( 8) = 1.69051 eV ==== + psi = 0.036*[# 2]+0.036*[# 3]+0.036*[# 4]+0.036*[# 7]+0.036*[# 16] + +0.036*[# 30]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 18] + +0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23]+0.031*[# 24] + +0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.002*[# 1] + +0.002*[# 5]+0.002*[# 9]+0.002*[# 13]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.002*[# 29] + |psi|^2 = 0.758 +==== e( 9) = 2.43371 eV ==== + psi = 0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17]+0.043*[# 21] + +0.043*[# 25]+0.043*[# 29]+0.043*[# 1]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 0.987 +==== e( 10) = 2.54749 eV ==== + psi = 0.045*[# 7]+0.045*[# 16]+0.045*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 14]+0.028*[# 15] + +0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23] + +0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.028*[# 31] + +0.028*[# 32]+0.015*[# 1]+0.010*[# 2]+0.010*[# 3]+0.010*[# 4] + +0.008*[# 9]+0.008*[# 17]+0.008*[# 21]+0.008*[# 25]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29] + |psi|^2 = 0.729 +==== e( 11) = 2.54759 eV ==== + psi = 0.077*[# 2]+0.077*[# 3]+0.077*[# 4]+0.041*[# 7]+0.041*[# 16] + +0.041*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29]+0.008*[# 9]+0.008*[# 17]+0.008*[# 21] + +0.008*[# 25] + |psi|^2 = 0.992 +==== e( 12) = 3.71718 eV ==== + psi = 0.034*[# 6]+0.034*[# 8]+0.034*[# 14]+0.034*[# 15]+0.034*[# 31] + +0.034*[# 32]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.016*[# 7]+0.016*[# 16] + +0.016*[# 30]+0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.680 +==== e( 13) = 3.84161 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 14]+0.050*[# 15]+0.050*[# 31]+0.050*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.002*[# 5]+0.002*[# 13]+0.002*[# 29]+0.001*[# 9] + +0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 3.84259 eV ==== + psi = 0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.063*[# 6]+0.063*[# 8] + +0.063*[# 14]+0.063*[# 15]+0.063*[# 31]+0.063*[# 32]+0.048*[# 10] + +0.048*[# 11]+0.048*[# 12]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.003*[# 1]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 5]+0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.158 +==== e( 15) = 4.03675 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.059*[# 7]+0.059*[# 16] + +0.059*[# 30]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 18] + +0.050*[# 19]+0.050*[# 20]+0.050*[# 22]+0.050*[# 23]+0.050*[# 24] + +0.050*[# 26]+0.050*[# 27]+0.050*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 1.206 +==== e( 16) = 5.60339 eV ==== + psi = 0.073*[# 2]+0.073*[# 3]+0.073*[# 4]+0.072*[# 7]+0.072*[# 16] + +0.072*[# 30]+0.057*[# 10]+0.057*[# 11]+0.057*[# 12]+0.057*[# 18] + +0.057*[# 19]+0.057*[# 20]+0.057*[# 22]+0.057*[# 23]+0.057*[# 24] + +0.057*[# 26]+0.057*[# 27]+0.057*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 1.364 + + k = 0.8333333333 0.3333333333 0.0000000000 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 6]+0.015*[# 7]+0.015*[# 8]+0.015*[# 10] + +0.015*[# 11]+0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 16] + +0.015*[# 18]+0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23] + +0.015*[# 24]+0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.015*[# 30] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 1.023 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.955 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.005*[# 2]+0.005*[# 3] + +0.005*[# 4]+0.005*[# 6]+0.005*[# 7]+0.005*[# 8]+0.005*[# 10] + +0.005*[# 11]+0.005*[# 12]+0.005*[# 14]+0.005*[# 15]+0.005*[# 16] + +0.005*[# 18]+0.005*[# 19]+0.005*[# 20]+0.005*[# 22]+0.005*[# 23] + +0.005*[# 24]+0.005*[# 26]+0.005*[# 27]+0.005*[# 28]+0.005*[# 30] + +0.005*[# 31]+0.005*[# 32] + |psi|^2 = 0.784 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.016*[# 6]+0.016*[# 7]+0.016*[# 8]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 14]+0.016*[# 15]+0.016*[# 16] + +0.016*[# 18]+0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23] + +0.016*[# 24]+0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.016*[# 30] + +0.016*[# 31]+0.016*[# 32] + |psi|^2 = 0.935 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 6]+0.023*[# 7]+0.023*[# 8]+0.023*[# 10] + +0.023*[# 11]+0.023*[# 12]+0.023*[# 14]+0.023*[# 15]+0.023*[# 16] + +0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23] + +0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.023*[# 30] + +0.023*[# 31]+0.023*[# 32] + |psi|^2 = 1.058 +==== e( 8) = 1.85450 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.986 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.034*[# 7]+0.034*[# 2]+0.034*[# 4]+0.034*[# 6]+0.034*[# 3] + +0.034*[# 8]+0.034*[# 16]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32] + |psi|^2 = 0.826 +==== e( 11) = 3.29155 eV ==== + psi = 0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.032*[# 7]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12] + +0.032*[# 16]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22] + +0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + +0.032*[# 30]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.802 +==== e( 12) = 3.36033 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.048*[# 7]+0.048*[# 16] + +0.048*[# 30]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.048*[# 6]+0.048*[# 8] + +0.048*[# 14]+0.048*[# 15]+0.048*[# 31]+0.048*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 1.161 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.033*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.033*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.033*[# 30]+0.034*[# 31]+0.034*[# 32] + |psi|^2 = 0.808 +==== e( 15) = 4.50839 eV ==== + psi = 0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.029*[# 6]+0.029*[# 7] + +0.029*[# 8]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14] + +0.029*[# 15]+0.029*[# 16]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.029*[# 30]+0.029*[# 31]+0.029*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.743 +==== e( 16) = 5.45761 eV ==== + psi = 0.057*[# 2]+0.057*[# 3]+0.057*[# 4]+0.056*[# 6]+0.056*[# 7] + +0.056*[# 8]+0.056*[# 10]+0.056*[# 11]+0.056*[# 12]+0.056*[# 14] + +0.056*[# 15]+0.056*[# 16]+0.056*[# 18]+0.056*[# 19]+0.056*[# 20] + +0.056*[# 22]+0.056*[# 23]+0.056*[# 24]+0.056*[# 26]+0.056*[# 27] + +0.056*[# 28]+0.056*[# 30]+0.056*[# 31]+0.056*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.383 + + k = 0.0000000000 0.5000000000 0.0000000000 +==== e( 1) = -4.74394 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4] + +0.022*[# 7]+0.022*[# 16]+0.022*[# 30]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + + |psi|^2 = 0.993 +==== e( 2) = -4.74289 eV ==== + psi = 0.181*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20] + +0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27] + +0.011*[# 28] + |psi|^2 = 0.993 +==== e( 3) = -1.49898 eV ==== + psi = 0.155*[# 9]+0.155*[# 17]+0.155*[# 21]+0.155*[# 25]+0.025*[# 2] + +0.025*[# 3]+0.025*[# 4]+0.016*[# 6]+0.016*[# 8]+0.016*[# 14] + +0.016*[# 15]+0.016*[# 31]+0.016*[# 32]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.807 +==== e( 4) = -1.49898 eV ==== + psi = 0.155*[# 9]+0.155*[# 17]+0.155*[# 21]+0.155*[# 25]+0.025*[# 7] + +0.025*[# 16]+0.025*[# 30]+0.016*[# 6]+0.016*[# 8]+0.016*[# 14] + +0.016*[# 15]+0.016*[# 31]+0.016*[# 32]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4] + |psi|^2 = 0.807 +==== e( 5) = -1.49886 eV ==== + psi = 0.206*[# 5]+0.206*[# 13]+0.206*[# 29]+0.031*[# 10]+0.031*[# 11] + +0.031*[# 12]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22] + +0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + + |psi|^2 = 0.995 +==== e( 6) = -1.49736 eV ==== + psi = 0.310*[# 1]+0.103*[# 5]+0.103*[# 13]+0.103*[# 29]+0.031*[# 10] + +0.031*[# 11]+0.031*[# 12]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20] + +0.031*[# 22]+0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27] + +0.031*[# 28] + |psi|^2 = 0.995 +==== e( 7) = 2.25746 eV ==== + psi = 0.064*[# 6]+0.064*[# 8]+0.064*[# 14]+0.064*[# 15]+0.064*[# 31] + +0.064*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + |psi|^2 = 0.876 +==== e( 8) = 2.25759 eV ==== + psi = 0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18]+0.048*[# 19] + +0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26] + +0.048*[# 27]+0.048*[# 28]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.876 +==== e( 9) = 2.25759 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 16]+0.051*[# 30] + +0.051*[# 31]+0.051*[# 32]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + |psi|^2 = 0.994 +==== e( 10) = 2.25771 eV ==== + psi = 0.094*[# 7]+0.094*[# 16]+0.094*[# 30]+0.085*[# 2]+0.085*[# 3] + +0.085*[# 4]+0.025*[# 6]+0.025*[# 8]+0.025*[# 10]+0.025*[# 11] + +0.025*[# 12]+0.025*[# 14]+0.025*[# 15]+0.025*[# 18]+0.025*[# 19] + +0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26] + +0.025*[# 27]+0.025*[# 28]+0.025*[# 31]+0.025*[# 32] + |psi|^2 = 0.994 +==== e( 11) = 2.64326 eV ==== + psi = 0.110*[# 1]+0.055*[# 9]+0.055*[# 17]+0.055*[# 21]+0.055*[# 25] + +0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18]+0.048*[# 19] + +0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26] + +0.048*[# 27]+0.048*[# 28]+0.045*[# 6]+0.045*[# 8]+0.045*[# 14] + +0.045*[# 15]+0.045*[# 31]+0.045*[# 32]+0.037*[# 5]+0.037*[# 13] + +0.037*[# 29] + |psi|^2 = 1.291 +==== e( 12) = 2.64358 eV ==== + psi = 0.074*[# 5]+0.074*[# 13]+0.074*[# 29]+0.055*[# 9]+0.055*[# 17] + +0.055*[# 21]+0.055*[# 25]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12] + +0.048*[# 18]+0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23] + +0.048*[# 24]+0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.046*[# 2] + +0.046*[# 3]+0.046*[# 4]+0.045*[# 7]+0.045*[# 16]+0.045*[# 30] + + |psi|^2 = 1.291 +==== e( 13) = 4.25697 eV ==== + psi = 0.082*[# 7]+0.082*[# 16]+0.082*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14]+0.041*[# 15] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.041*[# 31] + +0.041*[# 32] + |psi|^2 = 0.990 +==== e( 14) = 4.25697 eV ==== + psi = 0.082*[# 7]+0.082*[# 16]+0.082*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14]+0.041*[# 15] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.041*[# 31] + +0.041*[# 32] + |psi|^2 = 0.990 +==== e( 15) = 4.25808 eV ==== + psi = 0.080*[# 7]+0.080*[# 16]+0.080*[# 30]+0.077*[# 6]+0.077*[# 8] + +0.077*[# 14]+0.077*[# 15]+0.077*[# 31]+0.077*[# 32]+0.074*[# 2] + +0.074*[# 3]+0.074*[# 4]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12] + +0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23] + +0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + |psi|^2 = 1.049 +==== e( 16) = 4.25808 eV ==== + psi = 0.072*[# 10]+0.072*[# 11]+0.072*[# 12]+0.072*[# 18]+0.072*[# 19] + +0.072*[# 20]+0.072*[# 22]+0.072*[# 23]+0.072*[# 24]+0.072*[# 26] + +0.072*[# 27]+0.072*[# 28]+0.009*[# 2]+0.009*[# 3]+0.009*[# 4] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32]+0.003*[# 7]+0.003*[# 16]+0.003*[# 30] + |psi|^2 = 0.931 + + k = 0.1666666667 0.5000000000 0.0000000000 +==== e( 1) = -4.63271 eV ==== + psi = 0.120*[# 5]+0.120*[# 13]+0.120*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.001*[# 6]+0.001*[# 8]+0.001*[# 14]+0.001*[# 15]+0.001*[# 31] + +0.001*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.63166 eV ==== + psi = 0.180*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.002*[# 2]+0.002*[# 3]+0.002*[# 4]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 1.012 +==== e( 3) = -2.29294 eV ==== + psi = 0.110*[# 5]+0.110*[# 13]+0.110*[# 29]+0.082*[# 9]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.883 +==== e( 4) = -2.29202 eV ==== + psi = 0.164*[# 1]+0.082*[# 9]+0.082*[# 17]+0.082*[# 21]+0.082*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15] + +0.011*[# 31]+0.011*[# 32]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28] + |psi|^2 = 0.901 +==== e( 5) = -0.76680 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19] + +0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26] + +0.018*[# 27]+0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.994 +==== e( 6) = -0.76629 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.015*[# 6]+0.015*[# 8] + +0.015*[# 14]+0.015*[# 15]+0.015*[# 31]+0.015*[# 32]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.014*[# 7] + +0.014*[# 16]+0.014*[# 30] + |psi|^2 = 0.900 +==== e( 7) = 1.89706 eV ==== + psi = 0.049*[# 6]+0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 31] + +0.049*[# 32]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.003*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.857 +==== e( 8) = 1.89734 eV ==== + psi = 0.049*[# 7]+0.049*[# 16]+0.049*[# 30]+0.042*[# 2]+0.042*[# 3] + +0.042*[# 4]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 18] + +0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23]+0.031*[# 24] + +0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.017*[# 6]+0.017*[# 8] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.763 +==== e( 9) = 2.23554 eV ==== + psi = 0.103*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15]+0.040*[# 31] + +0.040*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.987 +==== e( 10) = 2.23572 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.039*[# 2]+0.039*[# 3]+0.039*[# 4] + +0.038*[# 7]+0.038*[# 16]+0.038*[# 30]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22] + +0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.950 +==== e( 11) = 3.04468 eV ==== + psi = 0.066*[# 7]+0.066*[# 16]+0.066*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.910 +==== e( 12) = 3.04476 eV ==== + psi = 0.053*[# 6]+0.053*[# 8]+0.053*[# 14]+0.053*[# 15]+0.053*[# 31] + +0.053*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.007*[# 7]+0.007*[# 16]+0.007*[# 30]+0.002*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.873 +==== e( 13) = 3.80535 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.989 +==== e( 14) = 3.80571 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.762 +==== e( 15) = 4.52337 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.060*[# 7]+0.060*[# 16] + +0.060*[# 30]+0.053*[# 10]+0.053*[# 11]+0.053*[# 12]+0.053*[# 18] + +0.053*[# 19]+0.053*[# 20]+0.053*[# 22]+0.053*[# 23]+0.053*[# 24] + +0.053*[# 26]+0.053*[# 27]+0.053*[# 28]+0.044*[# 6]+0.044*[# 8] + +0.044*[# 14]+0.044*[# 15]+0.044*[# 31]+0.044*[# 32]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 1.284 +==== e( 16) = 4.52360 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.043*[# 10] + +0.043*[# 11]+0.043*[# 12]+0.043*[# 18]+0.043*[# 19]+0.043*[# 20] + +0.043*[# 22]+0.043*[# 23]+0.043*[# 24]+0.043*[# 26]+0.043*[# 27] + +0.043*[# 28]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.006*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 1.057 + + k = 0.3333333333 0.5000000000 0.0000000000 +==== e( 1) = -4.30426 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.30321 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.015*[# 10] + +0.015*[# 11]+0.015*[# 12]+0.015*[# 18]+0.015*[# 19]+0.015*[# 20] + +0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26]+0.015*[# 27] + +0.015*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 1.056 +==== e( 3) = -3.08338 eV ==== + psi = 0.113*[# 5]+0.113*[# 13]+0.113*[# 29]+0.084*[# 9]+0.084*[# 17] + +0.084*[# 21]+0.084*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.011*[# 10]+0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19] + +0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26] + +0.011*[# 27]+0.011*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4] + |psi|^2 = 0.944 +==== e( 4) = -3.08238 eV ==== + psi = 0.169*[# 1]+0.084*[# 9]+0.084*[# 17]+0.084*[# 21]+0.084*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28] + |psi|^2 = 1.006 +==== e( 5) = -0.06735 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.060*[# 9]+0.060*[# 17] + +0.060*[# 21]+0.060*[# 25]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + +0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19] + +0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26] + +0.021*[# 27]+0.021*[# 28]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 16]+0.018*[# 30]+0.018*[# 31] + +0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.06705 eV ==== + psi = 0.121*[# 1]+0.060*[# 9]+0.060*[# 17]+0.060*[# 21]+0.060*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.015*[# 10] + +0.015*[# 11]+0.015*[# 12]+0.015*[# 18]+0.015*[# 19]+0.015*[# 20] + +0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26]+0.015*[# 27] + +0.015*[# 28]+0.012*[# 2]+0.012*[# 3]+0.012*[# 4]+0.012*[# 7] + +0.012*[# 16]+0.012*[# 30] + |psi|^2 = 0.849 +==== e( 7) = 1.46284 eV ==== + psi = 0.102*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.037*[# 6]+0.037*[# 8]+0.037*[# 14]+0.037*[# 15]+0.037*[# 31] + +0.037*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20] + +0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27] + +0.027*[# 28]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30]+0.011*[# 2] + +0.011*[# 3]+0.011*[# 4] + |psi|^2 = 1.055 +==== e( 8) = 1.46285 eV ==== + psi = 0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.021*[# 10]+0.021*[# 11] + +0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22] + +0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28] + +0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15]+0.011*[# 31] + +0.011*[# 32] + |psi|^2 = 0.911 +==== e( 9) = 1.95717 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 1.95751 eV ==== + psi = 0.042*[# 2]+0.042*[# 3]+0.042*[# 4]+0.042*[# 7]+0.042*[# 16] + +0.042*[# 30]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.762 +==== e( 11) = 3.02286 eV ==== + psi = 0.058*[# 2]+0.058*[# 3]+0.058*[# 4]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.020*[# 1]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.007*[# 5]+0.007*[# 13]+0.007*[# 29] + |psi|^2 = 0.936 +==== e( 12) = 3.02323 eV ==== + psi = 0.052*[# 7]+0.052*[# 16]+0.052*[# 30]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20]+0.026*[# 22] + +0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27]+0.026*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.013*[# 5]+0.013*[# 13]+0.013*[# 29]+0.013*[# 2] + +0.013*[# 3]+0.013*[# 4]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25] + |psi|^2 = 0.706 +==== e( 13) = 4.06622 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 4.06644 eV ==== + psi = 0.075*[# 6]+0.075*[# 8]+0.075*[# 14]+0.075*[# 15]+0.075*[# 31] + +0.075*[# 32]+0.057*[# 10]+0.057*[# 11]+0.057*[# 12]+0.057*[# 18] + +0.057*[# 19]+0.057*[# 20]+0.057*[# 22]+0.057*[# 23]+0.057*[# 24] + +0.057*[# 26]+0.057*[# 27]+0.057*[# 28]+0.038*[# 2]+0.038*[# 3] + +0.038*[# 4]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 1.368 +==== e( 15) = 4.88257 eV ==== + psi = 0.080*[# 7]+0.080*[# 16]+0.080*[# 30]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.978 +==== e( 16) = 4.88277 eV ==== + psi = 0.078*[# 2]+0.078*[# 3]+0.078*[# 4]+0.073*[# 6]+0.073*[# 8] + +0.073*[# 14]+0.073*[# 15]+0.073*[# 31]+0.073*[# 32]+0.056*[# 10] + +0.056*[# 11]+0.056*[# 12]+0.056*[# 18]+0.056*[# 19]+0.056*[# 20] + +0.056*[# 22]+0.056*[# 23]+0.056*[# 24]+0.056*[# 26]+0.056*[# 27] + +0.056*[# 28]+0.004*[# 1]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.001*[# 5]+0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.357 + + k = 0.5000000000 0.5000000000 0.0000000000 +==== e( 1) = -3.77594 eV ==== + psi = 0.115*[# 5]+0.115*[# 13]+0.115*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.045*[# 7]+0.045*[# 16]+0.045*[# 30] + +0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19] + +0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26] + +0.013*[# 27]+0.013*[# 28]+0.005*[# 2]+0.005*[# 3]+0.005*[# 4] + + |psi|^2 = 0.994 +==== e( 2) = -3.77569 eV ==== + psi = 0.115*[# 5]+0.115*[# 13]+0.115*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12]+0.017*[# 18] + +0.017*[# 19]+0.017*[# 20]+0.017*[# 22]+0.017*[# 23]+0.017*[# 24] + +0.017*[# 26]+0.017*[# 27]+0.017*[# 28] + |psi|^2 = 1.098 +==== e( 3) = -3.77569 eV ==== + psi = 0.115*[# 5]+0.115*[# 13]+0.115*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15]+0.014*[# 31] + +0.014*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18] + +0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24] + +0.013*[# 26]+0.013*[# 27]+0.013*[# 28] + |psi|^2 = 0.994 +==== e( 4) = -3.77387 eV ==== + psi = 0.345*[# 1]+0.086*[# 9]+0.086*[# 17]+0.086*[# 21]+0.086*[# 25] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30]+0.017*[# 10] + +0.017*[# 11]+0.017*[# 12]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20] + +0.017*[# 22]+0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27] + +0.017*[# 28]+0.002*[# 2]+0.002*[# 3]+0.002*[# 4] + |psi|^2 = 1.098 +==== e( 5) = 0.66844 eV ==== + psi = 0.072*[# 5]+0.072*[# 13]+0.072*[# 29]+0.054*[# 9]+0.054*[# 17] + +0.054*[# 21]+0.054*[# 25]+0.035*[# 6]+0.035*[# 8]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 31]+0.035*[# 32]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 18] + +0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23]+0.023*[# 24] + +0.023*[# 26]+0.023*[# 27]+0.023*[# 28] + |psi|^2 = 0.992 +==== e( 6) = 0.66844 eV ==== + psi = 0.072*[# 5]+0.072*[# 13]+0.072*[# 29]+0.054*[# 9]+0.054*[# 17] + +0.054*[# 21]+0.054*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.017*[# 10]+0.017*[# 11]+0.017*[# 12]+0.017*[# 18]+0.017*[# 19] + +0.017*[# 20]+0.017*[# 22]+0.017*[# 23]+0.017*[# 24]+0.017*[# 26] + +0.017*[# 27]+0.017*[# 28]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + +0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15]+0.012*[# 31] + +0.012*[# 32] + |psi|^2 = 0.851 +==== e( 7) = 0.66848 eV ==== + psi = 0.072*[# 5]+0.072*[# 13]+0.072*[# 29]+0.054*[# 9]+0.054*[# 17] + +0.054*[# 21]+0.054*[# 25]+0.047*[# 7]+0.047*[# 16]+0.047*[# 30] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 18]+0.023*[# 19]+0.023*[# 20] + +0.023*[# 22]+0.023*[# 23]+0.023*[# 24]+0.023*[# 26]+0.023*[# 27] + +0.023*[# 28]+0.023*[# 31]+0.023*[# 32] + |psi|^2 = 0.992 +==== e( 8) = 0.66874 eV ==== + psi = 0.217*[# 1]+0.054*[# 9]+0.054*[# 17]+0.054*[# 21]+0.054*[# 25] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12]+0.017*[# 18] + +0.017*[# 19]+0.017*[# 20]+0.017*[# 22]+0.017*[# 23]+0.017*[# 24] + +0.017*[# 26]+0.017*[# 27]+0.017*[# 28]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.008*[# 7]+0.008*[# 16]+0.008*[# 30] + |psi|^2 = 0.851 +==== e( 9) = 2.36032 eV ==== + psi = 0.080*[# 7]+0.080*[# 16]+0.080*[# 30]+0.038*[# 10]+0.038*[# 11] + +0.038*[# 12]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20]+0.038*[# 22] + +0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27]+0.038*[# 28] + +0.037*[# 1]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 31]+0.037*[# 32]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.991 +==== e( 10) = 2.36083 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 14]+0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20] + +0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27] + +0.027*[# 28]+0.012*[# 5]+0.012*[# 13]+0.012*[# 29]+0.009*[# 9] + +0.009*[# 17]+0.009*[# 21]+0.009*[# 25] + |psi|^2 = 0.732 +==== e( 11) = 2.36083 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.012*[# 5]+0.012*[# 13]+0.012*[# 29]+0.009*[# 9] + +0.009*[# 17]+0.009*[# 21]+0.009*[# 25] + |psi|^2 = 0.991 +==== e( 12) = 2.36105 eV ==== + psi = 0.084*[# 7]+0.084*[# 16]+0.084*[# 30]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.025*[# 2]+0.025*[# 3]+0.025*[# 4]+0.012*[# 5]+0.012*[# 13] + +0.012*[# 29]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21]+0.009*[# 25] + + |psi|^2 = 0.732 +==== e( 13) = 4.82921 eV ==== + psi = 0.165*[# 7]+0.165*[# 16]+0.165*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.989 +==== e( 14) = 4.82971 eV ==== + psi = 0.124*[# 6]+0.124*[# 8]+0.124*[# 14]+0.124*[# 15]+0.124*[# 31] + +0.124*[# 32]+0.062*[# 10]+0.062*[# 11]+0.062*[# 12]+0.062*[# 18] + +0.062*[# 19]+0.062*[# 20]+0.062*[# 22]+0.062*[# 23]+0.062*[# 24] + +0.062*[# 26]+0.062*[# 27]+0.062*[# 28] + |psi|^2 = 1.483 +==== e( 15) = 4.83052 eV ==== + psi = 0.082*[# 2]+0.082*[# 3]+0.082*[# 4]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14]+0.041*[# 15] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.041*[# 31] + +0.041*[# 32] + |psi|^2 = 0.989 +==== e( 16) = 4.83052 eV ==== + psi = 0.082*[# 2]+0.082*[# 3]+0.082*[# 4]+0.082*[# 6]+0.082*[# 8] + +0.082*[# 14]+0.082*[# 15]+0.082*[# 31]+0.082*[# 32]+0.062*[# 10] + +0.062*[# 11]+0.062*[# 12]+0.062*[# 18]+0.062*[# 19]+0.062*[# 20] + +0.062*[# 22]+0.062*[# 23]+0.062*[# 24]+0.062*[# 26]+0.062*[# 27] + +0.062*[# 28] + |psi|^2 = 1.483 + + k = 0.6666666667 0.5000000000 0.0000000000 +==== e( 1) = -4.30426 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.30321 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.015*[# 10] + +0.015*[# 11]+0.015*[# 12]+0.015*[# 18]+0.015*[# 19]+0.015*[# 20] + +0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26]+0.015*[# 27] + +0.015*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 1.056 +==== e( 3) = -3.08338 eV ==== + psi = 0.113*[# 5]+0.113*[# 13]+0.113*[# 29]+0.084*[# 9]+0.084*[# 17] + +0.084*[# 21]+0.084*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.011*[# 10]+0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19] + +0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26] + +0.011*[# 27]+0.011*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4] + |psi|^2 = 0.944 +==== e( 4) = -3.08238 eV ==== + psi = 0.169*[# 1]+0.084*[# 9]+0.084*[# 17]+0.084*[# 21]+0.084*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28] + |psi|^2 = 1.006 +==== e( 5) = -0.06735 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.060*[# 9]+0.060*[# 17] + +0.060*[# 21]+0.060*[# 25]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + +0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19] + +0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26] + +0.021*[# 27]+0.021*[# 28]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 16]+0.018*[# 30]+0.018*[# 31] + +0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.06705 eV ==== + psi = 0.121*[# 1]+0.060*[# 9]+0.060*[# 17]+0.060*[# 21]+0.060*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.015*[# 10] + +0.015*[# 11]+0.015*[# 12]+0.015*[# 18]+0.015*[# 19]+0.015*[# 20] + +0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26]+0.015*[# 27] + +0.015*[# 28]+0.012*[# 2]+0.012*[# 3]+0.012*[# 4]+0.012*[# 7] + +0.012*[# 16]+0.012*[# 30] + |psi|^2 = 0.849 +==== e( 7) = 1.46284 eV ==== + psi = 0.102*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.037*[# 6]+0.037*[# 8]+0.037*[# 14]+0.037*[# 15]+0.037*[# 31] + +0.037*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20] + +0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27] + +0.027*[# 28]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30]+0.011*[# 2] + +0.011*[# 3]+0.011*[# 4] + |psi|^2 = 1.055 +==== e( 8) = 1.46285 eV ==== + psi = 0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.021*[# 10]+0.021*[# 11] + +0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22] + +0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28] + +0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15]+0.011*[# 31] + +0.011*[# 32] + |psi|^2 = 0.911 +==== e( 9) = 1.95717 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 1.95751 eV ==== + psi = 0.042*[# 2]+0.042*[# 3]+0.042*[# 4]+0.042*[# 7]+0.042*[# 16] + +0.042*[# 30]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.762 +==== e( 11) = 3.02286 eV ==== + psi = 0.058*[# 2]+0.058*[# 3]+0.058*[# 4]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.020*[# 1]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.007*[# 5]+0.007*[# 13]+0.007*[# 29] + |psi|^2 = 0.936 +==== e( 12) = 3.02323 eV ==== + psi = 0.052*[# 7]+0.052*[# 16]+0.052*[# 30]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20]+0.026*[# 22] + +0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27]+0.026*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.013*[# 5]+0.013*[# 13]+0.013*[# 29]+0.013*[# 2] + +0.013*[# 3]+0.013*[# 4]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25] + |psi|^2 = 0.706 +==== e( 13) = 4.06622 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 4.06644 eV ==== + psi = 0.075*[# 6]+0.075*[# 8]+0.075*[# 14]+0.075*[# 15]+0.075*[# 31] + +0.075*[# 32]+0.057*[# 10]+0.057*[# 11]+0.057*[# 12]+0.057*[# 18] + +0.057*[# 19]+0.057*[# 20]+0.057*[# 22]+0.057*[# 23]+0.057*[# 24] + +0.057*[# 26]+0.057*[# 27]+0.057*[# 28]+0.038*[# 2]+0.038*[# 3] + +0.038*[# 4]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 1.368 +==== e( 15) = 4.88257 eV ==== + psi = 0.080*[# 7]+0.080*[# 16]+0.080*[# 30]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.978 +==== e( 16) = 4.88277 eV ==== + psi = 0.078*[# 2]+0.078*[# 3]+0.078*[# 4]+0.073*[# 6]+0.073*[# 8] + +0.073*[# 14]+0.073*[# 15]+0.073*[# 31]+0.073*[# 32]+0.056*[# 10] + +0.056*[# 11]+0.056*[# 12]+0.056*[# 18]+0.056*[# 19]+0.056*[# 20] + +0.056*[# 22]+0.056*[# 23]+0.056*[# 24]+0.056*[# 26]+0.056*[# 27] + +0.056*[# 28]+0.004*[# 1]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.001*[# 5]+0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.357 + + k = 0.8333333333 0.5000000000 0.0000000000 +==== e( 1) = -4.63271 eV ==== + psi = 0.120*[# 5]+0.120*[# 13]+0.120*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.001*[# 6]+0.001*[# 8]+0.001*[# 14]+0.001*[# 15]+0.001*[# 31] + +0.001*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.63166 eV ==== + psi = 0.180*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.002*[# 2]+0.002*[# 3]+0.002*[# 4]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 1.012 +==== e( 3) = -2.29294 eV ==== + psi = 0.110*[# 5]+0.110*[# 13]+0.110*[# 29]+0.082*[# 9]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.883 +==== e( 4) = -2.29202 eV ==== + psi = 0.164*[# 1]+0.082*[# 9]+0.082*[# 17]+0.082*[# 21]+0.082*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15] + +0.011*[# 31]+0.011*[# 32]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28] + |psi|^2 = 0.901 +==== e( 5) = -0.76680 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19] + +0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26] + +0.018*[# 27]+0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.994 +==== e( 6) = -0.76629 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.015*[# 6]+0.015*[# 8] + +0.015*[# 14]+0.015*[# 15]+0.015*[# 31]+0.015*[# 32]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.014*[# 7] + +0.014*[# 16]+0.014*[# 30] + |psi|^2 = 0.900 +==== e( 7) = 1.89706 eV ==== + psi = 0.049*[# 6]+0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 31] + +0.049*[# 32]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.003*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.857 +==== e( 8) = 1.89734 eV ==== + psi = 0.049*[# 7]+0.049*[# 16]+0.049*[# 30]+0.042*[# 2]+0.042*[# 3] + +0.042*[# 4]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 18] + +0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23]+0.031*[# 24] + +0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.017*[# 6]+0.017*[# 8] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.763 +==== e( 9) = 2.23554 eV ==== + psi = 0.103*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15]+0.040*[# 31] + +0.040*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.987 +==== e( 10) = 2.23572 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.039*[# 2]+0.039*[# 3]+0.039*[# 4] + +0.038*[# 7]+0.038*[# 16]+0.038*[# 30]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22] + +0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.950 +==== e( 11) = 3.04468 eV ==== + psi = 0.066*[# 7]+0.066*[# 16]+0.066*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.910 +==== e( 12) = 3.04476 eV ==== + psi = 0.053*[# 6]+0.053*[# 8]+0.053*[# 14]+0.053*[# 15]+0.053*[# 31] + +0.053*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.007*[# 7]+0.007*[# 16]+0.007*[# 30]+0.002*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.873 +==== e( 13) = 3.80535 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.989 +==== e( 14) = 3.80571 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.762 +==== e( 15) = 4.52337 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.060*[# 7]+0.060*[# 16] + +0.060*[# 30]+0.053*[# 10]+0.053*[# 11]+0.053*[# 12]+0.053*[# 18] + +0.053*[# 19]+0.053*[# 20]+0.053*[# 22]+0.053*[# 23]+0.053*[# 24] + +0.053*[# 26]+0.053*[# 27]+0.053*[# 28]+0.044*[# 6]+0.044*[# 8] + +0.044*[# 14]+0.044*[# 15]+0.044*[# 31]+0.044*[# 32]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 1.284 +==== e( 16) = 4.52360 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.043*[# 10] + +0.043*[# 11]+0.043*[# 12]+0.043*[# 18]+0.043*[# 19]+0.043*[# 20] + +0.043*[# 22]+0.043*[# 23]+0.043*[# 24]+0.043*[# 26]+0.043*[# 27] + +0.043*[# 28]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.006*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 1.057 + + k = 0.0000000000 0.6666666667 0.0000000000 +==== e( 1) = -5.34348 eV ==== + psi = 0.103*[# 5]+0.103*[# 9]+0.103*[# 13]+0.103*[# 17]+0.103*[# 21] + +0.103*[# 25]+0.103*[# 29]+0.103*[# 1]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4]+0.007*[# 6]+0.007*[# 7]+0.007*[# 8]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 14]+0.007*[# 15]+0.007*[# 16] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.007*[# 30] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.91783 eV ==== + psi = 0.082*[# 1]+0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.082*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 0.993 +==== e( 3) = -1.54469 eV ==== + psi = 0.152*[# 9]+0.152*[# 17]+0.152*[# 21]+0.152*[# 25]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14] + +0.011*[# 15]+0.011*[# 31]+0.011*[# 32] + |psi|^2 = 0.736 +==== e( 4) = -1.54469 eV ==== + psi = 0.152*[# 9]+0.152*[# 17]+0.152*[# 21]+0.152*[# 25]+0.032*[# 7] + +0.032*[# 16]+0.032*[# 30]+0.022*[# 6]+0.022*[# 8]+0.022*[# 14] + +0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.866 +==== e( 5) = -1.54458 eV ==== + psi = 0.202*[# 5]+0.202*[# 13]+0.202*[# 29]+0.032*[# 10]+0.032*[# 11] + +0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22] + +0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + + |psi|^2 = 0.994 +==== e( 6) = -1.54312 eV ==== + psi = 0.304*[# 1]+0.101*[# 5]+0.101*[# 13]+0.101*[# 29]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28] + |psi|^2 = 0.994 +==== e( 7) = 1.14721 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 6]+0.020*[# 7] + +0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.184 +==== e( 8) = 2.47079 eV ==== + psi = 0.066*[# 6]+0.066*[# 8]+0.066*[# 14]+0.066*[# 15]+0.066*[# 31] + +0.066*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.003*[# 5]+0.003*[# 13] + +0.003*[# 29] + |psi|^2 = 0.893 +==== e( 9) = 2.47096 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 6]+0.049*[# 7] + +0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 16]+0.049*[# 30] + +0.049*[# 31]+0.049*[# 32]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.002*[# 9] + +0.002*[# 17]+0.002*[# 21]+0.002*[# 25] + |psi|^2 = 0.994 +==== e( 10) = 2.47096 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 6]+0.049*[# 7] + +0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 16]+0.049*[# 30] + +0.049*[# 31]+0.049*[# 32]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.002*[# 9] + +0.002*[# 17]+0.002*[# 21]+0.002*[# 25] + |psi|^2 = 0.994 +==== e( 11) = 2.47113 eV ==== + psi = 0.093*[# 7]+0.093*[# 16]+0.093*[# 30]+0.088*[# 2]+0.088*[# 3] + +0.088*[# 4]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.004*[# 1] + +0.002*[# 5]+0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 3.72629 eV ==== + psi = 0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 14]+0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.034*[# 7] + +0.034*[# 16]+0.034*[# 30]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + |psi|^2 = 0.828 +==== e( 13) = 3.72629 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.993 +==== e( 14) = 4.12437 eV ==== + psi = 0.056*[# 2]+0.056*[# 3]+0.056*[# 4]+0.056*[# 6]+0.056*[# 7] + +0.056*[# 8]+0.056*[# 14]+0.056*[# 15]+0.056*[# 16]+0.056*[# 30] + +0.056*[# 31]+0.056*[# 32]+0.043*[# 1]+0.043*[# 5]+0.043*[# 9] + +0.043*[# 13]+0.043*[# 17]+0.043*[# 21]+0.043*[# 25]+0.043*[# 29] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19] + +0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26] + +0.035*[# 27]+0.035*[# 28] + |psi|^2 = 1.439 +==== e( 15) = 4.96156 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 14]+0.033*[# 15]+0.033*[# 16]+0.033*[# 30] + +0.033*[# 31]+0.033*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28] + |psi|^2 = 0.629 +==== e( 16) = 4.96156 eV ==== + psi = 0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19] + +0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26] + +0.021*[# 27]+0.021*[# 28]+0.008*[# 2]+0.008*[# 3]+0.008*[# 4] + +0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15] + +0.008*[# 16]+0.008*[# 30]+0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.354 + + k = 0.1666666667 0.6666666667 0.0000000000 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 6]+0.015*[# 7]+0.015*[# 8]+0.015*[# 10] + +0.015*[# 11]+0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 16] + +0.015*[# 18]+0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23] + +0.015*[# 24]+0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.015*[# 30] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 1.023 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.955 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.005*[# 2]+0.005*[# 3] + +0.005*[# 4]+0.005*[# 6]+0.005*[# 7]+0.005*[# 8]+0.005*[# 10] + +0.005*[# 11]+0.005*[# 12]+0.005*[# 14]+0.005*[# 15]+0.005*[# 16] + +0.005*[# 18]+0.005*[# 19]+0.005*[# 20]+0.005*[# 22]+0.005*[# 23] + +0.005*[# 24]+0.005*[# 26]+0.005*[# 27]+0.005*[# 28]+0.005*[# 30] + +0.005*[# 31]+0.005*[# 32] + |psi|^2 = 0.784 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.016*[# 6]+0.016*[# 7]+0.016*[# 8]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 14]+0.016*[# 15]+0.016*[# 16] + +0.016*[# 18]+0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23] + +0.016*[# 24]+0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.016*[# 30] + +0.016*[# 31]+0.016*[# 32] + |psi|^2 = 0.935 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 6]+0.023*[# 7]+0.023*[# 8]+0.023*[# 10] + +0.023*[# 11]+0.023*[# 12]+0.023*[# 14]+0.023*[# 15]+0.023*[# 16] + +0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23] + +0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.023*[# 30] + +0.023*[# 31]+0.023*[# 32] + |psi|^2 = 1.058 +==== e( 8) = 1.85450 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.986 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.034*[# 7]+0.034*[# 2]+0.034*[# 4]+0.034*[# 6]+0.034*[# 3] + +0.034*[# 8]+0.034*[# 16]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32] + |psi|^2 = 0.826 +==== e( 11) = 3.29155 eV ==== + psi = 0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.032*[# 7]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12] + +0.032*[# 16]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22] + +0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + +0.032*[# 30]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.802 +==== e( 12) = 3.36033 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.048*[# 7]+0.048*[# 16] + +0.048*[# 30]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.048*[# 6]+0.048*[# 8] + +0.048*[# 14]+0.048*[# 15]+0.048*[# 31]+0.048*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 1.161 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.033*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.033*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.033*[# 30]+0.034*[# 31]+0.034*[# 32] + |psi|^2 = 0.808 +==== e( 15) = 4.50839 eV ==== + psi = 0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.029*[# 6]+0.029*[# 7] + +0.029*[# 8]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14] + +0.029*[# 15]+0.029*[# 16]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.029*[# 30]+0.029*[# 31]+0.029*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.743 +==== e( 16) = 5.45761 eV ==== + psi = 0.057*[# 2]+0.057*[# 3]+0.057*[# 4]+0.056*[# 6]+0.056*[# 7] + +0.056*[# 8]+0.056*[# 10]+0.056*[# 11]+0.056*[# 12]+0.056*[# 14] + +0.056*[# 15]+0.056*[# 16]+0.056*[# 18]+0.056*[# 19]+0.056*[# 20] + +0.056*[# 22]+0.056*[# 23]+0.056*[# 24]+0.056*[# 26]+0.056*[# 27] + +0.056*[# 28]+0.056*[# 30]+0.056*[# 31]+0.056*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.383 + + k = 0.3333333333 0.6666666667 0.0000000000 +==== e( 1) = -4.87592 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.52951 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.017*[# 6]+0.017*[# 8]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20] + +0.017*[# 22]+0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27] + +0.017*[# 28]+0.017*[# 31]+0.017*[# 32]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30] + |psi|^2 = 1.085 +==== e( 3) = -3.52873 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.004*[# 2] + +0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -2.54529 eV ==== + psi = 0.085*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.085*[# 5]+0.085*[# 13]+0.085*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 7]+0.018*[# 16]+0.018*[# 30]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 1.015 +==== e( 5) = -0.62188 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.994 +==== e( 6) = 0.50951 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.061*[# 9]+0.061*[# 17] + +0.061*[# 21]+0.061*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.875 +==== e( 7) = 0.50974 eV ==== + psi = 0.122*[# 1]+0.061*[# 9]+0.061*[# 17]+0.061*[# 21]+0.061*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.029*[# 6]+0.029*[# 8] + +0.029*[# 14]+0.029*[# 15]+0.029*[# 31]+0.029*[# 32]+0.023*[# 7] + +0.023*[# 16]+0.023*[# 30]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12] + +0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23] + +0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.992 +==== e( 8) = 1.69051 eV ==== + psi = 0.036*[# 2]+0.036*[# 3]+0.036*[# 4]+0.036*[# 7]+0.036*[# 16] + +0.036*[# 30]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 18] + +0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23]+0.031*[# 24] + +0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.002*[# 1] + +0.002*[# 5]+0.002*[# 9]+0.002*[# 13]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.002*[# 29] + |psi|^2 = 0.758 +==== e( 9) = 2.43371 eV ==== + psi = 0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17]+0.043*[# 21] + +0.043*[# 25]+0.043*[# 29]+0.043*[# 1]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 0.987 +==== e( 10) = 2.54749 eV ==== + psi = 0.045*[# 7]+0.045*[# 16]+0.045*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 14]+0.028*[# 15] + +0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23] + +0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.028*[# 31] + +0.028*[# 32]+0.015*[# 1]+0.010*[# 2]+0.010*[# 3]+0.010*[# 4] + +0.008*[# 9]+0.008*[# 17]+0.008*[# 21]+0.008*[# 25]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29] + |psi|^2 = 0.729 +==== e( 11) = 2.54759 eV ==== + psi = 0.077*[# 2]+0.077*[# 3]+0.077*[# 4]+0.041*[# 7]+0.041*[# 16] + +0.041*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29]+0.008*[# 9]+0.008*[# 17]+0.008*[# 21] + +0.008*[# 25] + |psi|^2 = 0.992 +==== e( 12) = 3.71718 eV ==== + psi = 0.034*[# 6]+0.034*[# 8]+0.034*[# 14]+0.034*[# 15]+0.034*[# 31] + +0.034*[# 32]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.016*[# 7]+0.016*[# 16] + +0.016*[# 30]+0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.680 +==== e( 13) = 3.84161 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 14]+0.050*[# 15]+0.050*[# 31]+0.050*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.002*[# 5]+0.002*[# 13]+0.002*[# 29]+0.001*[# 9] + +0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 3.84259 eV ==== + psi = 0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.063*[# 6]+0.063*[# 8] + +0.063*[# 14]+0.063*[# 15]+0.063*[# 31]+0.063*[# 32]+0.048*[# 10] + +0.048*[# 11]+0.048*[# 12]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.003*[# 1]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 5]+0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.158 +==== e( 15) = 4.03675 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.059*[# 7]+0.059*[# 16] + +0.059*[# 30]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 18] + +0.050*[# 19]+0.050*[# 20]+0.050*[# 22]+0.050*[# 23]+0.050*[# 24] + +0.050*[# 26]+0.050*[# 27]+0.050*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 1.206 +==== e( 16) = 5.60339 eV ==== + psi = 0.073*[# 2]+0.073*[# 3]+0.073*[# 4]+0.072*[# 7]+0.072*[# 16] + +0.072*[# 30]+0.057*[# 10]+0.057*[# 11]+0.057*[# 12]+0.057*[# 18] + +0.057*[# 19]+0.057*[# 20]+0.057*[# 22]+0.057*[# 23]+0.057*[# 24] + +0.057*[# 26]+0.057*[# 27]+0.057*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 1.364 + + k = 0.5000000000 0.6666666667 0.0000000000 +==== e( 1) = -4.30426 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.30321 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.023*[# 2] + +0.023*[# 3]+0.023*[# 4]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28] + |psi|^2 = 1.179 +==== e( 3) = -3.08338 eV ==== + psi = 0.113*[# 5]+0.113*[# 13]+0.113*[# 29]+0.084*[# 9]+0.084*[# 17] + +0.084*[# 21]+0.084*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.011*[# 10]+0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19] + +0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26] + +0.011*[# 27]+0.011*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4] + |psi|^2 = 0.944 +==== e( 4) = -3.08238 eV ==== + psi = 0.169*[# 1]+0.084*[# 9]+0.084*[# 17]+0.084*[# 21]+0.084*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 18]+0.019*[# 19]+0.019*[# 20] + +0.019*[# 22]+0.019*[# 23]+0.019*[# 24]+0.019*[# 26]+0.019*[# 27] + +0.019*[# 28]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30]+0.015*[# 2] + +0.015*[# 3]+0.015*[# 4] + |psi|^2 = 1.130 +==== e( 5) = -0.06735 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.060*[# 9]+0.060*[# 17] + +0.060*[# 21]+0.060*[# 25]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + +0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19] + +0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26] + +0.021*[# 27]+0.021*[# 28]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 16]+0.018*[# 30]+0.018*[# 31] + +0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.06705 eV ==== + psi = 0.121*[# 1]+0.060*[# 9]+0.060*[# 17]+0.060*[# 21]+0.060*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12] + +0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23] + +0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + |psi|^2 = 0.776 +==== e( 7) = 1.46284 eV ==== + psi = 0.102*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.037*[# 6]+0.037*[# 8]+0.037*[# 14]+0.037*[# 15]+0.037*[# 31] + +0.037*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20] + +0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27] + +0.027*[# 28]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30]+0.011*[# 2] + +0.011*[# 3]+0.011*[# 4] + |psi|^2 = 1.055 +==== e( 8) = 1.46285 eV ==== + psi = 0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.036*[# 7]+0.036*[# 16]+0.036*[# 30] + +0.019*[# 2]+0.019*[# 3]+0.019*[# 4]+0.018*[# 10]+0.018*[# 11] + +0.018*[# 12]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22] + +0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28] + +0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15]+0.008*[# 31] + +0.008*[# 32] + |psi|^2 = 0.838 +==== e( 9) = 1.95717 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 1.95751 eV ==== + psi = 0.065*[# 7]+0.065*[# 16]+0.065*[# 30]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22] + +0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28] + +0.024*[# 2]+0.024*[# 3]+0.024*[# 4]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.826 +==== e( 11) = 3.02286 eV ==== + psi = 0.058*[# 2]+0.058*[# 3]+0.058*[# 4]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.020*[# 1]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.007*[# 5]+0.007*[# 13]+0.007*[# 29] + |psi|^2 = 0.936 +==== e( 12) = 3.02323 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.034*[# 7]+0.034*[# 16] + +0.034*[# 30]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.013*[# 5] + +0.013*[# 13]+0.013*[# 29]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25] + |psi|^2 = 0.770 +==== e( 13) = 4.06622 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 4.06644 eV ==== + psi = 0.075*[# 2]+0.075*[# 3]+0.075*[# 4]+0.075*[# 6]+0.075*[# 8] + +0.075*[# 14]+0.075*[# 15]+0.075*[# 31]+0.075*[# 32]+0.056*[# 10] + +0.056*[# 11]+0.056*[# 12]+0.056*[# 18]+0.056*[# 19]+0.056*[# 20] + +0.056*[# 22]+0.056*[# 23]+0.056*[# 24]+0.056*[# 26]+0.056*[# 27] + +0.056*[# 28]+0.003*[# 1]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 1.357 +==== e( 15) = 4.88257 eV ==== + psi = 0.080*[# 7]+0.080*[# 16]+0.080*[# 30]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.978 +==== e( 16) = 4.88277 eV ==== + psi = 0.072*[# 6]+0.072*[# 8]+0.072*[# 14]+0.072*[# 15]+0.072*[# 31] + +0.072*[# 32]+0.055*[# 10]+0.055*[# 11]+0.055*[# 12]+0.055*[# 18] + +0.055*[# 19]+0.055*[# 20]+0.055*[# 22]+0.055*[# 23]+0.055*[# 24] + +0.055*[# 26]+0.055*[# 27]+0.055*[# 28]+0.040*[# 2]+0.040*[# 3] + +0.040*[# 4]+0.037*[# 7]+0.037*[# 16]+0.037*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.345 + + k = 0.6666666667 0.6666666667 0.0000000000 +==== e( 1) = -4.87592 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.52951 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.017*[# 6]+0.017*[# 8]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20] + +0.017*[# 22]+0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27] + +0.017*[# 28]+0.017*[# 31]+0.017*[# 32]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30] + |psi|^2 = 1.085 +==== e( 3) = -3.52873 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.004*[# 2] + +0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -2.54529 eV ==== + psi = 0.085*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.085*[# 5]+0.085*[# 13]+0.085*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 7]+0.018*[# 16]+0.018*[# 30]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 1.015 +==== e( 5) = -0.62188 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.994 +==== e( 6) = 0.50951 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.061*[# 9]+0.061*[# 17] + +0.061*[# 21]+0.061*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.875 +==== e( 7) = 0.50974 eV ==== + psi = 0.122*[# 1]+0.061*[# 9]+0.061*[# 17]+0.061*[# 21]+0.061*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.029*[# 6]+0.029*[# 8] + +0.029*[# 14]+0.029*[# 15]+0.029*[# 31]+0.029*[# 32]+0.023*[# 7] + +0.023*[# 16]+0.023*[# 30]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12] + +0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23] + +0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.992 +==== e( 8) = 1.69051 eV ==== + psi = 0.036*[# 2]+0.036*[# 3]+0.036*[# 4]+0.036*[# 7]+0.036*[# 16] + +0.036*[# 30]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 18] + +0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23]+0.031*[# 24] + +0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.002*[# 1] + +0.002*[# 5]+0.002*[# 9]+0.002*[# 13]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.002*[# 29] + |psi|^2 = 0.758 +==== e( 9) = 2.43371 eV ==== + psi = 0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17]+0.043*[# 21] + +0.043*[# 25]+0.043*[# 29]+0.043*[# 1]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 0.987 +==== e( 10) = 2.54749 eV ==== + psi = 0.045*[# 7]+0.045*[# 16]+0.045*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 14]+0.028*[# 15] + +0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23] + +0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.028*[# 31] + +0.028*[# 32]+0.015*[# 1]+0.010*[# 2]+0.010*[# 3]+0.010*[# 4] + +0.008*[# 9]+0.008*[# 17]+0.008*[# 21]+0.008*[# 25]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29] + |psi|^2 = 0.729 +==== e( 11) = 2.54759 eV ==== + psi = 0.077*[# 2]+0.077*[# 3]+0.077*[# 4]+0.041*[# 7]+0.041*[# 16] + +0.041*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29]+0.008*[# 9]+0.008*[# 17]+0.008*[# 21] + +0.008*[# 25] + |psi|^2 = 0.992 +==== e( 12) = 3.71718 eV ==== + psi = 0.034*[# 6]+0.034*[# 8]+0.034*[# 14]+0.034*[# 15]+0.034*[# 31] + +0.034*[# 32]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.016*[# 7]+0.016*[# 16] + +0.016*[# 30]+0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.680 +==== e( 13) = 3.84161 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 14]+0.050*[# 15]+0.050*[# 31]+0.050*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.002*[# 5]+0.002*[# 13]+0.002*[# 29]+0.001*[# 9] + +0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 3.84259 eV ==== + psi = 0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.063*[# 6]+0.063*[# 8] + +0.063*[# 14]+0.063*[# 15]+0.063*[# 31]+0.063*[# 32]+0.048*[# 10] + +0.048*[# 11]+0.048*[# 12]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.003*[# 1]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 5]+0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.158 +==== e( 15) = 4.03675 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.059*[# 7]+0.059*[# 16] + +0.059*[# 30]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 18] + +0.050*[# 19]+0.050*[# 20]+0.050*[# 22]+0.050*[# 23]+0.050*[# 24] + +0.050*[# 26]+0.050*[# 27]+0.050*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 1.206 +==== e( 16) = 5.60339 eV ==== + psi = 0.073*[# 2]+0.073*[# 3]+0.073*[# 4]+0.072*[# 7]+0.072*[# 16] + +0.072*[# 30]+0.057*[# 10]+0.057*[# 11]+0.057*[# 12]+0.057*[# 18] + +0.057*[# 19]+0.057*[# 20]+0.057*[# 22]+0.057*[# 23]+0.057*[# 24] + +0.057*[# 26]+0.057*[# 27]+0.057*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 1.364 + + k = 0.8333333333 0.6666666667 0.0000000000 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 6]+0.015*[# 7]+0.015*[# 8]+0.015*[# 10] + +0.015*[# 11]+0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 16] + +0.015*[# 18]+0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23] + +0.015*[# 24]+0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.015*[# 30] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 1.023 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.955 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.005*[# 2]+0.005*[# 3] + +0.005*[# 4]+0.005*[# 6]+0.005*[# 7]+0.005*[# 8]+0.005*[# 10] + +0.005*[# 11]+0.005*[# 12]+0.005*[# 14]+0.005*[# 15]+0.005*[# 16] + +0.005*[# 18]+0.005*[# 19]+0.005*[# 20]+0.005*[# 22]+0.005*[# 23] + +0.005*[# 24]+0.005*[# 26]+0.005*[# 27]+0.005*[# 28]+0.005*[# 30] + +0.005*[# 31]+0.005*[# 32] + |psi|^2 = 0.784 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.016*[# 6]+0.016*[# 7]+0.016*[# 8]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 14]+0.016*[# 15]+0.016*[# 16] + +0.016*[# 18]+0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23] + +0.016*[# 24]+0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.016*[# 30] + +0.016*[# 31]+0.016*[# 32] + |psi|^2 = 0.935 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 6]+0.023*[# 7]+0.023*[# 8]+0.023*[# 10] + +0.023*[# 11]+0.023*[# 12]+0.023*[# 14]+0.023*[# 15]+0.023*[# 16] + +0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23] + +0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.023*[# 30] + +0.023*[# 31]+0.023*[# 32] + |psi|^2 = 1.058 +==== e( 8) = 1.85450 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.986 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.034*[# 7]+0.034*[# 2]+0.034*[# 4]+0.034*[# 6]+0.034*[# 3] + +0.034*[# 8]+0.034*[# 16]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32] + |psi|^2 = 0.826 +==== e( 11) = 3.29155 eV ==== + psi = 0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.032*[# 7]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12] + +0.032*[# 16]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22] + +0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + +0.032*[# 30]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.802 +==== e( 12) = 3.36033 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.048*[# 7]+0.048*[# 16] + +0.048*[# 30]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.048*[# 6]+0.048*[# 8] + +0.048*[# 14]+0.048*[# 15]+0.048*[# 31]+0.048*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 1.161 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.033*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.033*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.033*[# 30]+0.034*[# 31]+0.034*[# 32] + |psi|^2 = 0.808 +==== e( 15) = 4.50839 eV ==== + psi = 0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.029*[# 6]+0.029*[# 7] + +0.029*[# 8]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14] + +0.029*[# 15]+0.029*[# 16]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.029*[# 30]+0.029*[# 31]+0.029*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.743 +==== e( 16) = 5.45761 eV ==== + psi = 0.057*[# 2]+0.057*[# 3]+0.057*[# 4]+0.056*[# 6]+0.056*[# 7] + +0.056*[# 8]+0.056*[# 10]+0.056*[# 11]+0.056*[# 12]+0.056*[# 14] + +0.056*[# 15]+0.056*[# 16]+0.056*[# 18]+0.056*[# 19]+0.056*[# 20] + +0.056*[# 22]+0.056*[# 23]+0.056*[# 24]+0.056*[# 26]+0.056*[# 27] + +0.056*[# 28]+0.056*[# 30]+0.056*[# 31]+0.056*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.383 + + k = 0.0000000000 0.8333333333 0.0000000000 +==== e( 1) = -5.70745 eV ==== + psi = 0.117*[# 5]+0.117*[# 9]+0.117*[# 13]+0.117*[# 17]+0.117*[# 21] + +0.117*[# 25]+0.117*[# 29]+0.117*[# 1]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.002*[# 6]+0.002*[# 7]+0.002*[# 8]+0.002*[# 10] + +0.002*[# 11]+0.002*[# 12]+0.002*[# 14]+0.002*[# 15]+0.002*[# 16] + +0.002*[# 18]+0.002*[# 19]+0.002*[# 20]+0.002*[# 22]+0.002*[# 23] + +0.002*[# 24]+0.002*[# 26]+0.002*[# 27]+0.002*[# 28]+0.002*[# 30] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.88416 eV ==== + psi = 0.077*[# 5]+0.077*[# 9]+0.077*[# 13]+0.077*[# 17]+0.077*[# 21] + +0.077*[# 25]+0.077*[# 29]+0.076*[# 1]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.016*[# 6]+0.016*[# 7]+0.016*[# 8]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 14]+0.016*[# 15]+0.016*[# 16] + +0.016*[# 18]+0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23] + +0.016*[# 24]+0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.016*[# 30] + +0.016*[# 31]+0.016*[# 32] + |psi|^2 = 0.993 +==== e( 3) = -1.62947 eV ==== + psi = 0.147*[# 9]+0.147*[# 17]+0.147*[# 21]+0.147*[# 25]+0.032*[# 2] + +0.032*[# 3]+0.032*[# 4]+0.032*[# 6]+0.032*[# 7]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 16]+0.032*[# 30]+0.032*[# 31] + +0.032*[# 32] + |psi|^2 = 0.975 +==== e( 4) = -1.62947 eV ==== + psi = 0.147*[# 9]+0.147*[# 17]+0.147*[# 21]+0.147*[# 25]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4]+0.002*[# 6]+0.002*[# 7]+0.002*[# 8] + +0.002*[# 14]+0.002*[# 15]+0.002*[# 16]+0.002*[# 30]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.606 +==== e( 5) = -1.62936 eV ==== + psi = 0.196*[# 5]+0.196*[# 13]+0.196*[# 29]+0.034*[# 10]+0.034*[# 11] + +0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22] + +0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28] + + |psi|^2 = 0.993 +==== e( 6) = -1.62795 eV ==== + psi = 0.294*[# 1]+0.098*[# 5]+0.098*[# 13]+0.098*[# 29]+0.034*[# 10] + +0.034*[# 11]+0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28] + |psi|^2 = 0.993 +==== e( 7) = -0.30800 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 9]+0.068*[# 13]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.068*[# 29]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.019*[# 2]+0.019*[# 3]+0.019*[# 4]+0.019*[# 6]+0.019*[# 7] + +0.019*[# 8]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.195 +==== e( 8) = 2.97062 eV ==== + psi = 0.075*[# 6]+0.075*[# 8]+0.075*[# 14]+0.075*[# 15]+0.075*[# 31] + +0.075*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.004*[# 5]+0.004*[# 13] + +0.004*[# 29] + |psi|^2 = 0.929 +==== e( 9) = 2.97089 eV ==== + psi = 0.045*[# 6]+0.045*[# 8]+0.045*[# 14]+0.045*[# 15]+0.045*[# 31] + +0.045*[# 32]+0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.044*[# 7] + +0.044*[# 16]+0.044*[# 30]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.003*[# 9] + +0.003*[# 17]+0.003*[# 21]+0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.97089 eV ==== + psi = 0.045*[# 6]+0.044*[# 7]+0.045*[# 8]+0.044*[# 2]+0.045*[# 14] + +0.045*[# 15]+0.044*[# 4]+0.044*[# 3]+0.044*[# 16]+0.045*[# 31] + +0.044*[# 30]+0.045*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.003*[# 9] + +0.003*[# 17]+0.003*[# 21]+0.003*[# 25] + |psi|^2 = 0.993 +==== e( 11) = 2.97118 eV ==== + psi = 0.100*[# 7]+0.100*[# 16]+0.100*[# 30]+0.088*[# 2]+0.088*[# 3] + +0.088*[# 4]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.006*[# 1] + +0.002*[# 5]+0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.962 +==== e( 12) = 3.39927 eV ==== + psi = 0.071*[# 2]+0.071*[# 3]+0.071*[# 4]+0.066*[# 6]+0.066*[# 8] + +0.066*[# 14]+0.066*[# 15]+0.066*[# 31]+0.066*[# 32]+0.060*[# 7] + +0.060*[# 16]+0.060*[# 30] + |psi|^2 = 0.790 +==== e( 13) = 3.39927 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 5.47279 eV ==== + psi = 0.074*[# 10]+0.074*[# 11]+0.074*[# 12]+0.074*[# 18]+0.074*[# 19] + +0.074*[# 20]+0.074*[# 22]+0.074*[# 23]+0.074*[# 24]+0.074*[# 26] + +0.074*[# 27]+0.074*[# 28]+0.034*[# 2]+0.034*[# 3]+0.034*[# 4] + +0.034*[# 6]+0.034*[# 7]+0.034*[# 8]+0.034*[# 14]+0.034*[# 15] + +0.034*[# 16]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.022*[# 1] + +0.022*[# 5]+0.022*[# 9]+0.022*[# 13]+0.022*[# 17]+0.022*[# 21] + +0.022*[# 25]+0.022*[# 29] + |psi|^2 = 1.471 +==== e( 15) = 5.73469 eV ==== + psi = 0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.027*[# 6]+0.027*[# 7] + +0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 16]+0.027*[# 30] + +0.027*[# 31]+0.027*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28] + |psi|^2 = 0.561 +==== e( 16) = 5.73469 eV ==== + psi = 0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19] + +0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26] + +0.021*[# 27]+0.021*[# 28]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4] + +0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 16]+0.014*[# 30]+0.014*[# 31]+0.014*[# 32] + |psi|^2 = 0.411 + + k = 0.1666666667 0.8333333333 0.0000000000 +==== e( 1) = -5.58652 eV ==== + psi = 0.112*[# 5]+0.112*[# 9]+0.112*[# 13]+0.112*[# 17]+0.112*[# 21] + +0.112*[# 25]+0.112*[# 29]+0.111*[# 1]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.80598 eV ==== + psi = 0.103*[# 5]+0.103*[# 13]+0.103*[# 29]+0.077*[# 9]+0.077*[# 17] + +0.077*[# 21]+0.077*[# 25]+0.021*[# 2]+0.021*[# 3]+0.021*[# 4] + +0.017*[# 6]+0.017*[# 8]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20] + +0.017*[# 22]+0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27] + +0.017*[# 28]+0.017*[# 31]+0.017*[# 32]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30] + |psi|^2 = 1.033 +==== e( 3) = -2.80522 eV ==== + psi = 0.155*[# 1]+0.077*[# 9]+0.077*[# 17]+0.077*[# 21]+0.077*[# 25] + +0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.016*[# 6]+0.016*[# 8]+0.016*[# 14]+0.016*[# 15] + +0.016*[# 31]+0.016*[# 32]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 18]+0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23] + +0.016*[# 24]+0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.012*[# 2] + +0.012*[# 3]+0.012*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -1.80516 eV ==== + psi = 0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25]+0.079*[# 1] + +0.079*[# 5]+0.079*[# 13]+0.079*[# 29]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19]+0.009*[# 20] + +0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26]+0.009*[# 27] + +0.009*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.848 +==== e( 5) = -1.40568 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 13]+0.070*[# 29]+0.069*[# 9] + +0.069*[# 17]+0.069*[# 21]+0.069*[# 25]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.34433 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + +0.018*[# 6]+0.018*[# 8]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20] + +0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27] + +0.018*[# 28]+0.018*[# 31]+0.018*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.981 +==== e( 7) = -0.34382 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.019*[# 7] + +0.019*[# 16]+0.019*[# 30]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.014*[# 2] + +0.014*[# 3]+0.014*[# 4] + |psi|^2 = 0.993 +==== e( 8) = 2.26764 eV ==== + psi = 0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.043*[# 7]+0.043*[# 16] + +0.043*[# 30]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 1.014 +==== e( 9) = 3.00585 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 3.00589 eV ==== + psi = 0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.030*[# 10]+0.030*[# 11] + +0.030*[# 12]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22] + +0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28] + +0.023*[# 2]+0.023*[# 3]+0.023*[# 4]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.007*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.743 +==== e( 11) = 3.20562 eV ==== + psi = 0.081*[# 7]+0.081*[# 16]+0.081*[# 30]+0.048*[# 2]+0.048*[# 3] + +0.048*[# 4]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32] + |psi|^2 = 1.056 +==== e( 12) = 3.20630 eV ==== + psi = 0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.034*[# 10] + +0.034*[# 11]+0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30] + |psi|^2 = 0.807 +==== e( 13) = 3.48375 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 4.56822 eV ==== + psi = 0.047*[# 2]+0.047*[# 3]+0.047*[# 4]+0.047*[# 6]+0.047*[# 7] + +0.047*[# 8]+0.047*[# 10]+0.047*[# 11]+0.047*[# 12]+0.047*[# 14] + +0.047*[# 15]+0.047*[# 16]+0.047*[# 18]+0.047*[# 19]+0.047*[# 20] + +0.047*[# 22]+0.047*[# 23]+0.047*[# 24]+0.047*[# 26]+0.047*[# 27] + +0.047*[# 28]+0.047*[# 30]+0.047*[# 31]+0.047*[# 32]+0.026*[# 1] + +0.026*[# 5]+0.026*[# 9]+0.026*[# 13]+0.026*[# 17]+0.026*[# 21] + +0.026*[# 25]+0.026*[# 29] + |psi|^2 = 1.332 +==== e( 15) = 5.28998 eV ==== + psi = 0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.016*[# 6]+0.016*[# 7] + +0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 14] + +0.016*[# 15]+0.016*[# 16]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 30]+0.016*[# 31]+0.016*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.418 +==== e( 16) = 6.05492 eV ==== + psi = 0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.053*[# 6]+0.054*[# 7] + +0.053*[# 8]+0.054*[# 10]+0.054*[# 11]+0.054*[# 12]+0.053*[# 14] + +0.053*[# 15]+0.054*[# 16]+0.054*[# 18]+0.054*[# 19]+0.054*[# 20] + +0.054*[# 22]+0.054*[# 23]+0.054*[# 24]+0.054*[# 26]+0.054*[# 27] + +0.054*[# 28]+0.054*[# 30]+0.053*[# 31]+0.053*[# 32] + |psi|^2 = 1.285 + + k = 0.3333333333 0.8333333333 0.0000000000 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.141 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.955 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 1.088 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 0.887 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 6]+0.023*[# 7]+0.023*[# 8]+0.023*[# 10] + +0.023*[# 11]+0.023*[# 12]+0.023*[# 14]+0.023*[# 15]+0.023*[# 16] + +0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23] + +0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.023*[# 30] + +0.023*[# 31]+0.023*[# 32] + |psi|^2 = 1.058 +==== e( 8) = 1.85450 eV ==== + psi = 0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.029*[# 6]+0.029*[# 7] + +0.029*[# 8]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14] + +0.029*[# 15]+0.029*[# 16]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.029*[# 30]+0.029*[# 31]+0.029*[# 32] + |psi|^2 = 0.707 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.043*[# 7]+0.043*[# 2]+0.043*[# 4]+0.043*[# 6]+0.043*[# 3] + +0.043*[# 8]+0.043*[# 16]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 18]+0.043*[# 19]+0.043*[# 20] + +0.043*[# 22]+0.043*[# 23]+0.043*[# 24]+0.043*[# 26]+0.043*[# 27] + +0.043*[# 28]+0.043*[# 30]+0.043*[# 31]+0.043*[# 32] + |psi|^2 = 1.024 +==== e( 11) = 3.29155 eV ==== + psi = 0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.032*[# 7]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12] + +0.032*[# 16]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22] + +0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + +0.032*[# 30]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.802 +==== e( 12) = 3.36033 eV ==== + psi = 0.056*[# 2]+0.056*[# 3]+0.056*[# 4]+0.056*[# 7]+0.056*[# 16] + +0.056*[# 30]+0.056*[# 10]+0.056*[# 11]+0.056*[# 12]+0.056*[# 18] + +0.056*[# 19]+0.056*[# 20]+0.056*[# 22]+0.056*[# 23]+0.056*[# 24] + +0.056*[# 26]+0.056*[# 27]+0.056*[# 28]+0.055*[# 6]+0.055*[# 8] + +0.055*[# 14]+0.055*[# 15]+0.055*[# 31]+0.055*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 1.346 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.984 +==== e( 15) = 4.50839 eV ==== + psi = 0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.029*[# 6]+0.029*[# 7] + +0.029*[# 8]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14] + +0.029*[# 15]+0.029*[# 16]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.029*[# 30]+0.029*[# 31]+0.029*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.743 +==== e( 16) = 5.45761 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.991 + + k = 0.5000000000 0.8333333333 0.0000000000 +==== e( 1) = -4.63271 eV ==== + psi = 0.120*[# 5]+0.120*[# 13]+0.120*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.001*[# 6]+0.001*[# 8]+0.001*[# 14]+0.001*[# 15]+0.001*[# 31] + +0.001*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.63166 eV ==== + psi = 0.180*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.023*[# 2] + +0.023*[# 3]+0.023*[# 4]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12] + +0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23] + +0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + |psi|^2 = 1.239 +==== e( 3) = -2.29294 eV ==== + psi = 0.110*[# 5]+0.110*[# 13]+0.110*[# 29]+0.082*[# 9]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.883 +==== e( 4) = -2.29202 eV ==== + psi = 0.164*[# 1]+0.082*[# 9]+0.082*[# 17]+0.082*[# 21]+0.082*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.017*[# 2] + +0.017*[# 3]+0.017*[# 4] + |psi|^2 = 1.128 +==== e( 5) = -0.76680 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19] + +0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26] + +0.018*[# 27]+0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.994 +==== e( 6) = -0.76629 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28] + |psi|^2 = 0.759 +==== e( 7) = 1.89706 eV ==== + psi = 0.049*[# 6]+0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 31] + +0.049*[# 32]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.003*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.857 +==== e( 8) = 1.89734 eV ==== + psi = 0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.011*[# 6]+0.011*[# 8] + +0.011*[# 14]+0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.623 +==== e( 9) = 2.23554 eV ==== + psi = 0.103*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15]+0.040*[# 31] + +0.040*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.987 +==== e( 10) = 2.23572 eV ==== + psi = 0.070*[# 7]+0.070*[# 16]+0.070*[# 30]+0.069*[# 5]+0.069*[# 13] + +0.069*[# 29]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19] + +0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26] + +0.035*[# 27]+0.035*[# 28]+0.032*[# 2]+0.032*[# 3]+0.032*[# 4] + +0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15]+0.019*[# 31] + +0.019*[# 32] + |psi|^2 = 1.258 +==== e( 11) = 3.04468 eV ==== + psi = 0.066*[# 7]+0.066*[# 16]+0.066*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.910 +==== e( 12) = 3.04476 eV ==== + psi = 0.066*[# 6]+0.066*[# 8]+0.066*[# 14]+0.066*[# 15]+0.066*[# 31] + +0.066*[# 32]+0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.049*[# 10] + +0.049*[# 11]+0.049*[# 12]+0.049*[# 18]+0.049*[# 19]+0.049*[# 20] + +0.049*[# 22]+0.049*[# 23]+0.049*[# 24]+0.049*[# 26]+0.049*[# 27] + +0.049*[# 28]+0.002*[# 1]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 1.181 +==== e( 13) = 3.80535 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.989 +==== e( 14) = 3.80571 eV ==== + psi = 0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.020*[# 10]+0.020*[# 11] + +0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22] + +0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28] + +0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15]+0.017*[# 31] + +0.017*[# 32]+0.008*[# 5]+0.008*[# 13]+0.008*[# 29]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.520 +==== e( 15) = 4.52337 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.060*[# 7]+0.060*[# 16] + +0.060*[# 30]+0.053*[# 10]+0.053*[# 11]+0.053*[# 12]+0.053*[# 18] + +0.053*[# 19]+0.053*[# 20]+0.053*[# 22]+0.053*[# 23]+0.053*[# 24] + +0.053*[# 26]+0.053*[# 27]+0.053*[# 28]+0.044*[# 6]+0.044*[# 8] + +0.044*[# 14]+0.044*[# 15]+0.044*[# 31]+0.044*[# 32]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 1.284 +==== e( 16) = 4.52360 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.033*[# 10] + +0.033*[# 11]+0.033*[# 12]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.006*[# 1]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.002*[# 5]+0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.815 + + k = 0.6666666667 0.8333333333 0.0000000000 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.141 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.955 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 1.088 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 0.887 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 6]+0.023*[# 7]+0.023*[# 8]+0.023*[# 10] + +0.023*[# 11]+0.023*[# 12]+0.023*[# 14]+0.023*[# 15]+0.023*[# 16] + +0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23] + +0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.023*[# 30] + +0.023*[# 31]+0.023*[# 32] + |psi|^2 = 1.058 +==== e( 8) = 1.85450 eV ==== + psi = 0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.029*[# 6]+0.029*[# 7] + +0.029*[# 8]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14] + +0.029*[# 15]+0.029*[# 16]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.029*[# 30]+0.029*[# 31]+0.029*[# 32] + |psi|^2 = 0.707 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.043*[# 7]+0.043*[# 2]+0.043*[# 4]+0.043*[# 6]+0.043*[# 3] + +0.043*[# 8]+0.043*[# 16]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 18]+0.043*[# 19]+0.043*[# 20] + +0.043*[# 22]+0.043*[# 23]+0.043*[# 24]+0.043*[# 26]+0.043*[# 27] + +0.043*[# 28]+0.043*[# 30]+0.043*[# 31]+0.043*[# 32] + |psi|^2 = 1.024 +==== e( 11) = 3.29155 eV ==== + psi = 0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.032*[# 7]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12] + +0.032*[# 16]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22] + +0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + +0.032*[# 30]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.802 +==== e( 12) = 3.36033 eV ==== + psi = 0.056*[# 2]+0.056*[# 3]+0.056*[# 4]+0.056*[# 7]+0.056*[# 16] + +0.056*[# 30]+0.056*[# 10]+0.056*[# 11]+0.056*[# 12]+0.056*[# 18] + +0.056*[# 19]+0.056*[# 20]+0.056*[# 22]+0.056*[# 23]+0.056*[# 24] + +0.056*[# 26]+0.056*[# 27]+0.056*[# 28]+0.055*[# 6]+0.055*[# 8] + +0.055*[# 14]+0.055*[# 15]+0.055*[# 31]+0.055*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 1.346 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.984 +==== e( 15) = 4.50839 eV ==== + psi = 0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.029*[# 6]+0.029*[# 7] + +0.029*[# 8]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14] + +0.029*[# 15]+0.029*[# 16]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.029*[# 30]+0.029*[# 31]+0.029*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.743 +==== e( 16) = 5.45761 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.991 + + k = 0.8333333333 0.8333333333 0.0000000000 +==== e( 1) = -5.58652 eV ==== + psi = 0.112*[# 5]+0.112*[# 9]+0.112*[# 13]+0.112*[# 17]+0.112*[# 21] + +0.112*[# 25]+0.112*[# 29]+0.111*[# 1]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.80598 eV ==== + psi = 0.103*[# 5]+0.103*[# 13]+0.103*[# 29]+0.077*[# 9]+0.077*[# 17] + +0.077*[# 21]+0.077*[# 25]+0.021*[# 2]+0.021*[# 3]+0.021*[# 4] + +0.017*[# 6]+0.017*[# 8]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20] + +0.017*[# 22]+0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27] + +0.017*[# 28]+0.017*[# 31]+0.017*[# 32]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30] + |psi|^2 = 1.033 +==== e( 3) = -2.80522 eV ==== + psi = 0.155*[# 1]+0.077*[# 9]+0.077*[# 17]+0.077*[# 21]+0.077*[# 25] + +0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.016*[# 6]+0.016*[# 8]+0.016*[# 14]+0.016*[# 15] + +0.016*[# 31]+0.016*[# 32]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 18]+0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23] + +0.016*[# 24]+0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.012*[# 2] + +0.012*[# 3]+0.012*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -1.80516 eV ==== + psi = 0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25]+0.079*[# 1] + +0.079*[# 5]+0.079*[# 13]+0.079*[# 29]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19]+0.009*[# 20] + +0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26]+0.009*[# 27] + +0.009*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.848 +==== e( 5) = -1.40568 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 13]+0.070*[# 29]+0.069*[# 9] + +0.069*[# 17]+0.069*[# 21]+0.069*[# 25]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.34433 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + +0.018*[# 6]+0.018*[# 8]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20] + +0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27] + +0.018*[# 28]+0.018*[# 31]+0.018*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.981 +==== e( 7) = -0.34382 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.019*[# 7] + +0.019*[# 16]+0.019*[# 30]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.014*[# 2] + +0.014*[# 3]+0.014*[# 4] + |psi|^2 = 0.993 +==== e( 8) = 2.26764 eV ==== + psi = 0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.043*[# 7]+0.043*[# 16] + +0.043*[# 30]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 1.014 +==== e( 9) = 3.00585 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 3.00589 eV ==== + psi = 0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.030*[# 10]+0.030*[# 11] + +0.030*[# 12]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22] + +0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28] + +0.023*[# 2]+0.023*[# 3]+0.023*[# 4]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.007*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.743 +==== e( 11) = 3.20562 eV ==== + psi = 0.081*[# 7]+0.081*[# 16]+0.081*[# 30]+0.048*[# 2]+0.048*[# 3] + +0.048*[# 4]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32] + |psi|^2 = 1.056 +==== e( 12) = 3.20630 eV ==== + psi = 0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.034*[# 10] + +0.034*[# 11]+0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30] + |psi|^2 = 0.807 +==== e( 13) = 3.48375 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 4.56822 eV ==== + psi = 0.047*[# 2]+0.047*[# 3]+0.047*[# 4]+0.047*[# 6]+0.047*[# 7] + +0.047*[# 8]+0.047*[# 10]+0.047*[# 11]+0.047*[# 12]+0.047*[# 14] + +0.047*[# 15]+0.047*[# 16]+0.047*[# 18]+0.047*[# 19]+0.047*[# 20] + +0.047*[# 22]+0.047*[# 23]+0.047*[# 24]+0.047*[# 26]+0.047*[# 27] + +0.047*[# 28]+0.047*[# 30]+0.047*[# 31]+0.047*[# 32]+0.026*[# 1] + +0.026*[# 5]+0.026*[# 9]+0.026*[# 13]+0.026*[# 17]+0.026*[# 21] + +0.026*[# 25]+0.026*[# 29] + |psi|^2 = 1.332 +==== e( 15) = 5.28998 eV ==== + psi = 0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.016*[# 6]+0.016*[# 7] + +0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 14] + +0.016*[# 15]+0.016*[# 16]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 30]+0.016*[# 31]+0.016*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.418 +==== e( 16) = 6.05492 eV ==== + psi = 0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.054*[# 6]+0.054*[# 7] + +0.054*[# 8]+0.054*[# 10]+0.054*[# 11]+0.054*[# 12]+0.054*[# 14] + +0.054*[# 15]+0.054*[# 16]+0.054*[# 18]+0.054*[# 19]+0.054*[# 20] + +0.054*[# 22]+0.054*[# 23]+0.054*[# 24]+0.054*[# 26]+0.054*[# 27] + +0.054*[# 28]+0.054*[# 30]+0.054*[# 31]+0.054*[# 32] + |psi|^2 = 1.285 + + k = 0.0000000000 0.0000000000 0.1666666667 +==== e( 1) = -5.70745 eV ==== + psi = 0.117*[# 5]+0.117*[# 9]+0.117*[# 13]+0.117*[# 17]+0.117*[# 21] + +0.117*[# 25]+0.117*[# 29]+0.117*[# 1]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.002*[# 6]+0.002*[# 7]+0.002*[# 8]+0.002*[# 10] + +0.002*[# 11]+0.002*[# 12]+0.002*[# 14]+0.002*[# 15]+0.002*[# 16] + +0.002*[# 18]+0.002*[# 19]+0.002*[# 20]+0.002*[# 22]+0.002*[# 23] + +0.002*[# 24]+0.002*[# 26]+0.002*[# 27]+0.002*[# 28]+0.002*[# 30] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.88416 eV ==== + psi = 0.077*[# 5]+0.077*[# 9]+0.077*[# 13]+0.077*[# 17]+0.077*[# 21] + +0.077*[# 25]+0.077*[# 29]+0.076*[# 1] + |psi|^2 = 0.613 +==== e( 3) = -1.62947 eV ==== + psi = 0.147*[# 9]+0.147*[# 17]+0.147*[# 21]+0.147*[# 25]+0.050*[# 2] + +0.050*[# 3]+0.050*[# 4]+0.050*[# 6]+0.050*[# 7]+0.050*[# 8] + +0.050*[# 14]+0.050*[# 15]+0.050*[# 16]+0.050*[# 30]+0.050*[# 31] + +0.050*[# 32]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 18] + +0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23]+0.016*[# 24] + +0.016*[# 26]+0.016*[# 27]+0.016*[# 28] + |psi|^2 = 1.373 +==== e( 4) = -1.62947 eV ==== + psi = 0.147*[# 9]+0.147*[# 17]+0.147*[# 21]+0.147*[# 25]+0.034*[# 2] + +0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 16]+0.034*[# 30]+0.034*[# 31] + +0.034*[# 32] + |psi|^2 = 0.993 +==== e( 5) = -1.62936 eV ==== + psi = 0.196*[# 5]+0.196*[# 13]+0.196*[# 29]+0.034*[# 10]+0.034*[# 11] + +0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22] + +0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28] + + |psi|^2 = 0.993 +==== e( 6) = -1.62795 eV ==== + psi = 0.294*[# 1]+0.098*[# 5]+0.098*[# 13]+0.098*[# 29]+0.051*[# 10] + +0.051*[# 11]+0.051*[# 12]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28] + |psi|^2 = 1.196 +==== e( 7) = -0.30800 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 9]+0.068*[# 13]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.068*[# 29] + |psi|^2 = 0.546 +==== e( 8) = 2.97062 eV ==== + psi = 0.061*[# 10]+0.061*[# 11]+0.061*[# 12]+0.061*[# 18]+0.061*[# 19] + +0.061*[# 20]+0.061*[# 22]+0.061*[# 23]+0.061*[# 24]+0.061*[# 26] + +0.061*[# 27]+0.061*[# 28]+0.004*[# 5]+0.004*[# 13]+0.004*[# 29] + + |psi|^2 = 0.749 +==== e( 9) = 2.97089 eV ==== + psi = 0.045*[# 6]+0.045*[# 8]+0.045*[# 14]+0.045*[# 15]+0.045*[# 31] + +0.045*[# 32]+0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.044*[# 7] + +0.044*[# 16]+0.044*[# 30]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.003*[# 9] + +0.003*[# 17]+0.003*[# 21]+0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.97089 eV ==== + psi = 0.083*[# 6]+0.083*[# 8]+0.083*[# 14]+0.083*[# 15]+0.083*[# 31] + +0.083*[# 32]+0.053*[# 2]+0.053*[# 3]+0.053*[# 4]+0.053*[# 7] + +0.053*[# 16]+0.053*[# 30]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.834 +==== e( 11) = 2.97118 eV ==== + psi = 0.082*[# 10]+0.082*[# 11]+0.082*[# 12]+0.082*[# 18]+0.082*[# 19] + +0.082*[# 20]+0.082*[# 22]+0.082*[# 23]+0.082*[# 24]+0.082*[# 26] + +0.082*[# 27]+0.082*[# 28]+0.006*[# 1]+0.002*[# 5]+0.002*[# 13] + +0.002*[# 29] + |psi|^2 = 0.993 +==== e( 12) = 3.39927 eV ==== + psi = 0.077*[# 7]+0.077*[# 16]+0.077*[# 30]+0.077*[# 2]+0.077*[# 3] + +0.077*[# 4]+0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15] + +0.047*[# 31]+0.047*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + |psi|^2 = 1.240 +==== e( 13) = 3.39927 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 5.47279 eV ==== + psi = 0.036*[# 2]+0.036*[# 3]+0.036*[# 4]+0.036*[# 6]+0.036*[# 8] + +0.036*[# 14]+0.036*[# 15]+0.036*[# 31]+0.036*[# 32]+0.036*[# 7] + +0.036*[# 16]+0.036*[# 30]+0.022*[# 1]+0.022*[# 5]+0.022*[# 9] + +0.022*[# 13]+0.022*[# 17]+0.022*[# 21]+0.022*[# 25]+0.022*[# 29] + +0.006*[# 10]+0.006*[# 11]+0.006*[# 12]+0.006*[# 18]+0.006*[# 19] + +0.006*[# 20]+0.006*[# 22]+0.006*[# 23]+0.006*[# 24]+0.006*[# 26] + +0.006*[# 27]+0.006*[# 28] + |psi|^2 = 0.681 +==== e( 15) = 5.73469 eV ==== + psi = 0.074*[# 2]+0.074*[# 3]+0.074*[# 4]+0.074*[# 6]+0.074*[# 7] + +0.074*[# 8]+0.074*[# 10]+0.074*[# 11]+0.074*[# 12]+0.074*[# 14] + +0.074*[# 15]+0.074*[# 16]+0.074*[# 18]+0.074*[# 19]+0.074*[# 20] + +0.074*[# 22]+0.074*[# 23]+0.074*[# 24]+0.074*[# 26]+0.074*[# 27] + +0.074*[# 28]+0.074*[# 30]+0.074*[# 31]+0.074*[# 32] + |psi|^2 = 1.766 +==== e( 16) = 5.73469 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.040*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.040*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.040*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.972 + + k = 0.1666666667 0.0000000000 0.1666666667 +==== e( 1) = -5.58652 eV ==== + psi = 0.112*[# 5]+0.112*[# 9]+0.112*[# 13]+0.112*[# 17]+0.112*[# 21] + +0.112*[# 25]+0.112*[# 29]+0.111*[# 1]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.80598 eV ==== + psi = 0.103*[# 5]+0.103*[# 13]+0.103*[# 29]+0.077*[# 9]+0.077*[# 17] + +0.077*[# 21]+0.077*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15]+0.011*[# 31] + +0.011*[# 32]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.861 +==== e( 3) = -2.80522 eV ==== + psi = 0.155*[# 1]+0.077*[# 9]+0.077*[# 17]+0.077*[# 21]+0.077*[# 25] + +0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -1.80516 eV ==== + psi = 0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25]+0.079*[# 1] + +0.079*[# 5]+0.079*[# 13]+0.079*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.022*[# 6]+0.022*[# 8]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 14]+0.022*[# 15]+0.022*[# 18]+0.022*[# 19] + +0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26] + +0.022*[# 27]+0.022*[# 28]+0.022*[# 31]+0.022*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 1.159 +==== e( 5) = -1.40568 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 13]+0.070*[# 29]+0.069*[# 9] + +0.069*[# 17]+0.069*[# 21]+0.069*[# 25]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.34433 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14] + +0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.011*[# 2]+0.011*[# 3]+0.011*[# 4]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.812 +==== e( 7) = -0.34382 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20] + +0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27] + +0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32] + |psi|^2 = 0.993 +==== e( 8) = 2.26764 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14]+0.033*[# 15] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.033*[# 31] + +0.033*[# 32]+0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.796 +==== e( 9) = 3.00585 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 3.00589 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.061*[# 7]+0.061*[# 16] + +0.061*[# 30]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.007*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.993 +==== e( 11) = 3.20562 eV ==== + psi = 0.057*[# 6]+0.057*[# 8]+0.057*[# 14]+0.057*[# 15]+0.057*[# 31] + +0.057*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.948 +==== e( 12) = 3.20630 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.056*[# 7]+0.056*[# 16] + +0.056*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32] + |psi|^2 = 0.948 +==== e( 13) = 3.48375 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 4.56822 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.026*[# 1] + +0.026*[# 5]+0.026*[# 9]+0.026*[# 13]+0.026*[# 17]+0.026*[# 21] + +0.026*[# 25]+0.026*[# 29] + |psi|^2 = 1.160 +==== e( 15) = 5.28999 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.048*[# 6]+0.048*[# 7] + +0.048*[# 8]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 14] + +0.048*[# 15]+0.048*[# 16]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.048*[# 30]+0.048*[# 31]+0.048*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.166 +==== e( 16) = 6.05492 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32] + |psi|^2 = 0.800 + + k = 0.3333333333 0.0000000000 0.1666666667 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.135 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.708 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 6]+0.023*[# 7]+0.023*[# 8]+0.023*[# 10] + +0.023*[# 11]+0.023*[# 12]+0.023*[# 14]+0.023*[# 15]+0.023*[# 16] + +0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23] + +0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.023*[# 30] + +0.023*[# 31]+0.023*[# 32] + |psi|^2 = 1.221 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4]+0.007*[# 6]+0.007*[# 7]+0.007*[# 8]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 14]+0.007*[# 15]+0.007*[# 16] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.007*[# 30] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.729 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 6]+0.032*[# 7]+0.032*[# 8]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15]+0.032*[# 16] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 30] + +0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.259 +==== e( 8) = 1.85450 eV ==== + psi = 0.028*[# 2]+0.028*[# 3]+0.028*[# 4]+0.028*[# 6]+0.028*[# 7] + +0.028*[# 8]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 14] + +0.028*[# 15]+0.028*[# 16]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.028*[# 30]+0.028*[# 31]+0.028*[# 32] + |psi|^2 = 0.668 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.046*[# 6]+0.046*[# 7] + +0.046*[# 8]+0.046*[# 10]+0.046*[# 11]+0.046*[# 12]+0.046*[# 14] + +0.046*[# 15]+0.046*[# 16]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.046*[# 30]+0.046*[# 31]+0.046*[# 32] + |psi|^2 = 1.106 +==== e( 11) = 3.29155 eV ==== + psi = 0.035*[# 7]+0.035*[# 16]+0.035*[# 30]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23] + +0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.865 +==== e( 12) = 3.36033 eV ==== + psi = 0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.039*[# 6]+0.039*[# 8] + +0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 14]+0.039*[# 15] + +0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23] + +0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.039*[# 31] + +0.039*[# 32]+0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.950 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 7]+0.034*[# 6] + +0.034*[# 8]+0.035*[# 10]+0.035*[# 16]+0.035*[# 11]+0.035*[# 12] + +0.034*[# 14]+0.034*[# 15]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 30]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26] + +0.035*[# 27]+0.035*[# 28]+0.034*[# 31]+0.034*[# 32] + |psi|^2 = 0.831 +==== e( 15) = 4.50839 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.050*[# 6]+0.050*[# 7] + +0.050*[# 8]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 14] + +0.050*[# 15]+0.050*[# 16]+0.050*[# 18]+0.050*[# 19]+0.050*[# 20] + +0.050*[# 22]+0.050*[# 23]+0.050*[# 24]+0.050*[# 26]+0.050*[# 27] + +0.050*[# 28]+0.050*[# 30]+0.050*[# 31]+0.050*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.248 +==== e( 16) = 5.45761 eV ==== + psi = 0.023*[# 2]+0.023*[# 3]+0.023*[# 4]+0.023*[# 6]+0.023*[# 7] + +0.023*[# 8]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 14] + +0.023*[# 15]+0.023*[# 16]+0.023*[# 18]+0.023*[# 19]+0.023*[# 20] + +0.023*[# 22]+0.023*[# 23]+0.023*[# 24]+0.023*[# 26]+0.023*[# 27] + +0.023*[# 28]+0.023*[# 30]+0.023*[# 31]+0.023*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.578 + + k = 0.5000000000 0.0000000000 0.1666666667 +==== e( 1) = -4.63271 eV ==== + psi = 0.120*[# 5]+0.120*[# 13]+0.120*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.001*[# 6]+0.001*[# 8]+0.001*[# 14]+0.001*[# 15]+0.001*[# 31] + +0.001*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.63166 eV ==== + psi = 0.180*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.021*[# 2]+0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.220 +==== e( 3) = -2.29294 eV ==== + psi = 0.110*[# 5]+0.110*[# 13]+0.110*[# 29]+0.082*[# 9]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4] + +0.007*[# 10]+0.007*[# 11]+0.007*[# 12]+0.007*[# 18]+0.007*[# 19] + +0.007*[# 20]+0.007*[# 22]+0.007*[# 23]+0.007*[# 24]+0.007*[# 26] + +0.007*[# 27]+0.007*[# 28]+0.006*[# 6]+0.006*[# 8]+0.006*[# 14] + +0.006*[# 15]+0.006*[# 31]+0.006*[# 32]+0.002*[# 7]+0.002*[# 16] + +0.002*[# 30] + |psi|^2 = 0.817 +==== e( 4) = -2.29202 eV ==== + psi = 0.164*[# 1]+0.082*[# 9]+0.082*[# 17]+0.082*[# 21]+0.082*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.030*[# 7]+0.030*[# 16] + +0.030*[# 30]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 18]+0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23] + +0.016*[# 24]+0.016*[# 26]+0.016*[# 27]+0.016*[# 28] + |psi|^2 = 1.044 +==== e( 5) = -0.76680 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19] + +0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26] + +0.018*[# 27]+0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.994 +==== e( 6) = -0.76629 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.853 +==== e( 7) = 1.89706 eV ==== + psi = 0.052*[# 6]+0.052*[# 8]+0.052*[# 14]+0.052*[# 15]+0.052*[# 31] + +0.052*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.003*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.910 +==== e( 8) = 1.89734 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.031*[# 10]+0.031*[# 11] + +0.031*[# 12]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22] + +0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + +0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.017*[# 6]+0.017*[# 8] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.769 +==== e( 9) = 2.23554 eV ==== + psi = 0.103*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15]+0.040*[# 31] + +0.040*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.987 +==== e( 10) = 2.23572 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.064*[# 7]+0.064*[# 16] + +0.064*[# 30]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.042*[# 2]+0.042*[# 3]+0.042*[# 4]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32] + |psi|^2 = 1.295 +==== e( 11) = 3.04468 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.040*[# 7]+0.040*[# 16] + +0.040*[# 30]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.011*[# 6]+0.011*[# 8] + +0.011*[# 14]+0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.688 +==== e( 12) = 3.04476 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.002*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.996 +==== e( 13) = 3.80535 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.989 +==== e( 14) = 3.80571 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.026*[# 6]+0.026*[# 8]+0.026*[# 14]+0.026*[# 15]+0.026*[# 31] + +0.026*[# 32]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.747 +==== e( 15) = 4.52337 eV ==== + psi = 0.043*[# 7]+0.043*[# 16]+0.043*[# 30]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 18] + +0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23]+0.032*[# 24] + +0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.787 +==== e( 16) = 4.52360 eV ==== + psi = 0.030*[# 6]+0.030*[# 8]+0.030*[# 14]+0.030*[# 15]+0.030*[# 31] + +0.030*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.006*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.545 + + k = 0.6666666667 0.0000000000 0.1666666667 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.135 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.708 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 6]+0.023*[# 7]+0.023*[# 8]+0.023*[# 10] + +0.023*[# 11]+0.023*[# 12]+0.023*[# 14]+0.023*[# 15]+0.023*[# 16] + +0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23] + +0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.023*[# 30] + +0.023*[# 31]+0.023*[# 32] + |psi|^2 = 1.221 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4]+0.007*[# 6]+0.007*[# 7]+0.007*[# 8]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 14]+0.007*[# 15]+0.007*[# 16] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.007*[# 30] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.729 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 6]+0.032*[# 7]+0.032*[# 8]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15]+0.032*[# 16] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 30] + +0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.259 +==== e( 8) = 1.85450 eV ==== + psi = 0.028*[# 2]+0.028*[# 3]+0.028*[# 4]+0.028*[# 6]+0.028*[# 7] + +0.028*[# 8]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 14] + +0.028*[# 15]+0.028*[# 16]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.028*[# 30]+0.028*[# 31]+0.028*[# 32] + |psi|^2 = 0.668 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.046*[# 6]+0.046*[# 7] + +0.046*[# 8]+0.046*[# 10]+0.046*[# 11]+0.046*[# 12]+0.046*[# 14] + +0.046*[# 15]+0.046*[# 16]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.046*[# 30]+0.046*[# 31]+0.046*[# 32] + |psi|^2 = 1.106 +==== e( 11) = 3.29155 eV ==== + psi = 0.035*[# 7]+0.035*[# 16]+0.035*[# 30]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23] + +0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.865 +==== e( 12) = 3.36033 eV ==== + psi = 0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.039*[# 6]+0.039*[# 8] + +0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 14]+0.039*[# 15] + +0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23] + +0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.039*[# 31] + +0.039*[# 32]+0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.950 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 7]+0.034*[# 6] + +0.034*[# 8]+0.035*[# 10]+0.035*[# 16]+0.035*[# 11]+0.035*[# 12] + +0.034*[# 14]+0.034*[# 15]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 30]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26] + +0.035*[# 27]+0.035*[# 28]+0.034*[# 31]+0.034*[# 32] + |psi|^2 = 0.831 +==== e( 15) = 4.50839 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.050*[# 6]+0.050*[# 7] + +0.050*[# 8]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 14] + +0.050*[# 15]+0.050*[# 16]+0.050*[# 18]+0.050*[# 19]+0.050*[# 20] + +0.050*[# 22]+0.050*[# 23]+0.050*[# 24]+0.050*[# 26]+0.050*[# 27] + +0.050*[# 28]+0.050*[# 30]+0.050*[# 31]+0.050*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.248 +==== e( 16) = 5.45761 eV ==== + psi = 0.023*[# 2]+0.023*[# 3]+0.023*[# 4]+0.023*[# 6]+0.023*[# 7] + +0.023*[# 8]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 14] + +0.023*[# 15]+0.023*[# 16]+0.023*[# 18]+0.023*[# 19]+0.023*[# 20] + +0.023*[# 22]+0.023*[# 23]+0.023*[# 24]+0.023*[# 26]+0.023*[# 27] + +0.023*[# 28]+0.023*[# 30]+0.023*[# 31]+0.023*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.578 + + k = 0.8333333333 0.0000000000 0.1666666667 +==== e( 1) = -5.58652 eV ==== + psi = 0.112*[# 5]+0.112*[# 9]+0.112*[# 13]+0.112*[# 17]+0.112*[# 21] + +0.112*[# 25]+0.112*[# 29]+0.111*[# 1]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.80598 eV ==== + psi = 0.103*[# 5]+0.103*[# 13]+0.103*[# 29]+0.077*[# 9]+0.077*[# 17] + +0.077*[# 21]+0.077*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15]+0.011*[# 31] + +0.011*[# 32]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.861 +==== e( 3) = -2.80522 eV ==== + psi = 0.155*[# 1]+0.077*[# 9]+0.077*[# 17]+0.077*[# 21]+0.077*[# 25] + +0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -1.80516 eV ==== + psi = 0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25]+0.079*[# 1] + +0.079*[# 5]+0.079*[# 13]+0.079*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.022*[# 6]+0.022*[# 8]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 14]+0.022*[# 15]+0.022*[# 18]+0.022*[# 19] + +0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26] + +0.022*[# 27]+0.022*[# 28]+0.022*[# 31]+0.022*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 1.159 +==== e( 5) = -1.40568 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 13]+0.070*[# 29]+0.069*[# 9] + +0.069*[# 17]+0.069*[# 21]+0.069*[# 25]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.34433 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14] + +0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.011*[# 2]+0.011*[# 3]+0.011*[# 4]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.812 +==== e( 7) = -0.34382 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20] + +0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27] + +0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32] + |psi|^2 = 0.993 +==== e( 8) = 2.26764 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14]+0.033*[# 15] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.033*[# 31] + +0.033*[# 32]+0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.796 +==== e( 9) = 3.00585 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 3.00589 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.061*[# 7]+0.061*[# 16] + +0.061*[# 30]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.007*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.993 +==== e( 11) = 3.20562 eV ==== + psi = 0.057*[# 6]+0.057*[# 8]+0.057*[# 14]+0.057*[# 15]+0.057*[# 31] + +0.057*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.948 +==== e( 12) = 3.20630 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.056*[# 7]+0.056*[# 16] + +0.056*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32] + |psi|^2 = 0.948 +==== e( 13) = 3.48375 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 4.56822 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.026*[# 1] + +0.026*[# 5]+0.026*[# 9]+0.026*[# 13]+0.026*[# 17]+0.026*[# 21] + +0.026*[# 25]+0.026*[# 29] + |psi|^2 = 1.160 +==== e( 15) = 5.28998 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.048*[# 6]+0.048*[# 7] + +0.048*[# 8]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 14] + +0.048*[# 15]+0.048*[# 16]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.048*[# 30]+0.048*[# 31]+0.048*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.166 +==== e( 16) = 6.05492 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32] + |psi|^2 = 0.800 + + k = 0.0000000000 0.1666666667 0.1666666667 +==== e( 1) = -5.58652 eV ==== + psi = 0.112*[# 5]+0.112*[# 9]+0.112*[# 13]+0.112*[# 17]+0.112*[# 21] + +0.112*[# 25]+0.112*[# 29]+0.111*[# 1]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.80598 eV ==== + psi = 0.103*[# 5]+0.103*[# 13]+0.103*[# 29]+0.077*[# 9]+0.077*[# 17] + +0.077*[# 21]+0.077*[# 25]+0.009*[# 2]+0.009*[# 3]+0.009*[# 4] + +0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15]+0.008*[# 31] + +0.008*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.812 +==== e( 3) = -2.80522 eV ==== + psi = 0.155*[# 1]+0.077*[# 9]+0.077*[# 17]+0.077*[# 21]+0.077*[# 25] + +0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -1.80516 eV ==== + psi = 0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25]+0.079*[# 1] + +0.079*[# 5]+0.079*[# 13]+0.079*[# 29]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30]+0.015*[# 6]+0.015*[# 8]+0.015*[# 10]+0.015*[# 11] + +0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 18]+0.015*[# 19] + +0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26] + +0.015*[# 27]+0.015*[# 28]+0.015*[# 31]+0.015*[# 32]+0.014*[# 2] + +0.014*[# 3]+0.014*[# 4] + |psi|^2 = 0.987 +==== e( 5) = -1.40568 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 13]+0.070*[# 29]+0.069*[# 9] + +0.069*[# 17]+0.069*[# 21]+0.069*[# 25]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.34433 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.028*[# 6]+0.028*[# 8]+0.028*[# 14] + +0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20]+0.026*[# 22] + +0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27]+0.026*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.024*[# 7]+0.024*[# 16] + +0.024*[# 30] + |psi|^2 = 1.182 +==== e( 7) = -0.34382 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20] + +0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27] + +0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32] + |psi|^2 = 0.993 +==== e( 8) = 2.26764 eV ==== + psi = 0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 14]+0.026*[# 15] + +0.026*[# 18]+0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23] + +0.026*[# 24]+0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.026*[# 31] + +0.026*[# 32]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.626 +==== e( 9) = 3.00585 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 3.00589 eV ==== + psi = 0.098*[# 7]+0.098*[# 16]+0.098*[# 30]+0.051*[# 10]+0.051*[# 11] + +0.051*[# 12]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20]+0.051*[# 22] + +0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27]+0.051*[# 28] + +0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.007*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 1.243 +==== e( 11) = 3.20562 eV ==== + psi = 0.057*[# 6]+0.057*[# 8]+0.057*[# 14]+0.057*[# 15]+0.057*[# 31] + +0.057*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.948 +==== e( 12) = 3.20630 eV ==== + psi = 0.096*[# 2]+0.096*[# 3]+0.096*[# 4]+0.050*[# 10]+0.050*[# 11] + +0.050*[# 12]+0.050*[# 18]+0.050*[# 19]+0.050*[# 20]+0.050*[# 22] + +0.050*[# 23]+0.050*[# 24]+0.050*[# 26]+0.050*[# 27]+0.050*[# 28] + +0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.198 +==== e( 13) = 3.48375 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 4.56822 eV ==== + psi = 0.026*[# 1]+0.026*[# 5]+0.026*[# 9]+0.026*[# 13]+0.026*[# 17] + +0.026*[# 21]+0.026*[# 25]+0.026*[# 29]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.663 +==== e( 15) = 5.28998 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.048*[# 6]+0.048*[# 7] + +0.048*[# 8]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 14] + +0.048*[# 15]+0.048*[# 16]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.048*[# 30]+0.048*[# 31]+0.048*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.166 +==== e( 16) = 6.05492 eV ==== + psi = 0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.026*[# 6]+0.026*[# 7] + +0.026*[# 8]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 14] + +0.026*[# 15]+0.026*[# 16]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20] + +0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27] + +0.026*[# 28]+0.026*[# 30]+0.026*[# 31]+0.026*[# 32] + |psi|^2 = 0.628 + + k = 0.1666666667 0.1666666667 0.1666666667 +==== e( 1) = -5.46675 eV ==== + psi = 0.107*[# 5]+0.107*[# 9]+0.107*[# 13]+0.107*[# 17]+0.107*[# 21] + +0.107*[# 25]+0.107*[# 29]+0.107*[# 1]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4]+0.006*[# 6]+0.006*[# 7]+0.006*[# 8]+0.006*[# 10] + +0.006*[# 11]+0.006*[# 12]+0.006*[# 14]+0.006*[# 15]+0.006*[# 16] + +0.006*[# 18]+0.006*[# 19]+0.006*[# 20]+0.006*[# 22]+0.006*[# 23] + +0.006*[# 24]+0.006*[# 26]+0.006*[# 27]+0.006*[# 28]+0.006*[# 30] + +0.006*[# 31]+0.006*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + +0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15]+0.015*[# 31] + +0.015*[# 32]+0.015*[# 10]+0.015*[# 11]+0.015*[# 12]+0.015*[# 18] + +0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24] + +0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.013*[# 7]+0.013*[# 16] + +0.013*[# 30] + |psi|^2 = 0.992 +==== e( 3) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14] + +0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18] + +0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24] + +0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.845 +==== e( 4) = -2.74636 eV ==== + psi = 0.237*[# 1]+0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25] + +0.026*[# 5]+0.026*[# 13]+0.026*[# 29]+0.024*[# 7]+0.024*[# 16] + +0.024*[# 30]+0.019*[# 10]+0.019*[# 11]+0.019*[# 12]+0.019*[# 18] + +0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23]+0.019*[# 24] + +0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32] + |psi|^2 = 1.097 +==== e( 5) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.019*[# 10]+0.019*[# 11]+0.019*[# 12]+0.019*[# 18] + +0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23]+0.019*[# 24] + +0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14] + +0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 18] + +0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23]+0.016*[# 24] + +0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.011*[# 7]+0.011*[# 16] + +0.011*[# 30] + |psi|^2 = 0.935 +==== e( 7) = -0.41176 eV ==== + psi = 0.204*[# 1]+0.068*[# 9]+0.068*[# 17]+0.068*[# 21]+0.068*[# 25] + +0.028*[# 7]+0.028*[# 16]+0.028*[# 30]+0.023*[# 5]+0.023*[# 13] + +0.023*[# 29]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.063 +==== e( 8) = 2.48448 eV ==== + psi = 0.037*[# 7]+0.037*[# 16]+0.037*[# 30]+0.030*[# 10]+0.030*[# 11] + +0.030*[# 12]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22] + +0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28] + +0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.753 +==== e( 9) = 2.48448 eV ==== + psi = 0.056*[# 6]+0.056*[# 8]+0.056*[# 14]+0.056*[# 15]+0.056*[# 31] + +0.056*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.029*[# 7]+0.029*[# 16] + +0.029*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.48501 eV ==== + psi = 0.071*[# 7]+0.071*[# 16]+0.071*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.009*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.035 +==== e( 11) = 3.58915 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.985 +==== e( 12) = 3.58971 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.055*[# 7]+0.055*[# 16] + +0.055*[# 30]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32] + |psi|^2 = 1.068 +==== e( 13) = 3.58971 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 7]+0.062*[# 16] + +0.062*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 3.76658 eV ==== + psi = 0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.030*[# 31] + +0.030*[# 32]+0.028*[# 1]+0.028*[# 5]+0.028*[# 9]+0.028*[# 13] + +0.028*[# 17]+0.028*[# 21]+0.028*[# 25]+0.028*[# 29]+0.027*[# 2] + +0.027*[# 3]+0.027*[# 4] + |psi|^2 = 0.947 +==== e( 15) = 5.71627 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.037*[# 6]+0.037*[# 7] + +0.037*[# 8]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 16]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.037*[# 30]+0.037*[# 31]+0.037*[# 32] + |psi|^2 = 0.877 +==== e( 16) = 5.71627 eV ==== + psi = 0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.039*[# 6]+0.039*[# 7] + +0.039*[# 8]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 14] + +0.039*[# 15]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.039*[# 30]+0.039*[# 31]+0.039*[# 32] + |psi|^2 = 0.926 + + k = 0.3333333333 0.1666666667 0.1666666667 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.118 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.136 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.026*[# 7]+0.026*[# 16] + +0.026*[# 30]+0.015*[# 10]+0.015*[# 11]+0.015*[# 12]+0.015*[# 18] + +0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24] + +0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.012*[# 6]+0.012*[# 8] + +0.012*[# 14]+0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4] + |psi|^2 = 0.853 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.020*[# 7]+0.020*[# 16] + +0.020*[# 30]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.743 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.045*[# 2]+0.045*[# 3]+0.045*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 1.070 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.985 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23] + +0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.040*[# 31] + +0.040*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.952 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.030*[# 6]+0.030*[# 7] + +0.030*[# 8]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14] + +0.030*[# 15]+0.030*[# 16]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.030*[# 30]+0.030*[# 31]+0.030*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.807 + + k = 0.5000000000 0.1666666667 0.1666666667 +==== e( 1) = -4.52498 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.52394 eV ==== + psi = 0.179*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28] + |psi|^2 = 1.202 +==== e( 3) = -2.53521 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.875 +==== e( 4) = -2.53429 eV ==== + psi = 0.172*[# 1]+0.086*[# 9]+0.086*[# 17]+0.086*[# 21]+0.086*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12]+0.017*[# 18] + +0.017*[# 19]+0.017*[# 20]+0.017*[# 22]+0.017*[# 23]+0.017*[# 24] + +0.017*[# 26]+0.017*[# 27]+0.017*[# 28]+0.016*[# 6]+0.016*[# 8] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 31]+0.016*[# 32]+0.008*[# 2] + +0.008*[# 3]+0.008*[# 4] + |psi|^2 = 1.084 +==== e( 5) = -0.69955 eV ==== + psi = 0.078*[# 5]+0.078*[# 13]+0.078*[# 29]+0.059*[# 9]+0.059*[# 17] + +0.059*[# 21]+0.059*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.69934 eV ==== + psi = 0.117*[# 1]+0.059*[# 9]+0.059*[# 17]+0.059*[# 21]+0.059*[# 25] + +0.039*[# 5]+0.039*[# 13]+0.039*[# 29]+0.029*[# 7]+0.029*[# 16] + +0.029*[# 30]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 18] + +0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23]+0.016*[# 24] + +0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.013*[# 6]+0.013*[# 8] + +0.013*[# 14]+0.013*[# 15]+0.013*[# 31]+0.013*[# 32]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4] + |psi|^2 = 0.856 +==== e( 7) = 1.70960 eV ==== + psi = 0.051*[# 5]+0.051*[# 13]+0.051*[# 29]+0.048*[# 7]+0.048*[# 16] + +0.048*[# 30]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.029*[# 1]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.020*[# 2] + +0.020*[# 3]+0.020*[# 4] + |psi|^2 = 1.035 +==== e( 8) = 1.71009 eV ==== + psi = 0.062*[# 1]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.027*[# 2] + +0.027*[# 3]+0.027*[# 4]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12] + +0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23] + +0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.899 +==== e( 9) = 2.10371 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.10436 eV ==== + psi = 0.050*[# 7]+0.050*[# 16]+0.050*[# 30]+0.045*[# 2]+0.045*[# 3] + +0.045*[# 4]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.017*[# 1] + +0.009*[# 9]+0.009*[# 17]+0.009*[# 21]+0.009*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 0.938 +==== e( 11) = 3.36740 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30] + |psi|^2 = 1.043 +==== e( 12) = 3.36742 eV ==== + psi = 0.067*[# 2]+0.067*[# 3]+0.067*[# 4]+0.051*[# 7]+0.051*[# 16] + +0.051*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.001*[# 1] + + |psi|^2 = 0.988 +==== e( 13) = 4.14946 eV ==== + psi = 0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.028*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.988 +==== e( 14) = 4.14988 eV ==== + psi = 0.056*[# 7]+0.056*[# 16]+0.056*[# 30]+0.052*[# 2]+0.052*[# 3] + +0.052*[# 4]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.002*[# 1] + |psi|^2 = 1.156 +==== e( 15) = 4.40345 eV ==== + psi = 0.042*[# 7]+0.042*[# 16]+0.042*[# 30]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.030*[# 31] + +0.030*[# 32]+0.019*[# 2]+0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.728 +==== e( 16) = 4.40456 eV ==== + psi = 0.069*[# 2]+0.069*[# 3]+0.069*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.896 + + k = 0.6666666667 0.1666666667 0.1666666667 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.118 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.136 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.026*[# 7]+0.026*[# 16] + +0.026*[# 30]+0.015*[# 10]+0.015*[# 11]+0.015*[# 12]+0.015*[# 18] + +0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24] + +0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.012*[# 6]+0.012*[# 8] + +0.012*[# 14]+0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4] + |psi|^2 = 0.853 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.020*[# 7]+0.020*[# 16] + +0.020*[# 30]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.743 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.045*[# 2]+0.045*[# 3]+0.045*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 1.070 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.985 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23] + +0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.040*[# 31] + +0.040*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.952 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.030*[# 6]+0.030*[# 7] + +0.030*[# 8]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14] + +0.030*[# 15]+0.030*[# 16]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.030*[# 30]+0.030*[# 31]+0.030*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.807 + + k = 0.8333333333 0.1666666667 0.1666666667 +==== e( 1) = -5.46675 eV ==== + psi = 0.107*[# 5]+0.107*[# 9]+0.107*[# 13]+0.107*[# 17]+0.107*[# 21] + +0.107*[# 25]+0.107*[# 29]+0.107*[# 1]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4]+0.006*[# 6]+0.006*[# 7]+0.006*[# 8]+0.006*[# 10] + +0.006*[# 11]+0.006*[# 12]+0.006*[# 14]+0.006*[# 15]+0.006*[# 16] + +0.006*[# 18]+0.006*[# 19]+0.006*[# 20]+0.006*[# 22]+0.006*[# 23] + +0.006*[# 24]+0.006*[# 26]+0.006*[# 27]+0.006*[# 28]+0.006*[# 30] + +0.006*[# 31]+0.006*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15]+0.011*[# 31] + +0.011*[# 32]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.872 +==== e( 3) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4] + +0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15]+0.019*[# 31] + +0.019*[# 32]+0.019*[# 10]+0.019*[# 11]+0.019*[# 12]+0.019*[# 18] + +0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23]+0.019*[# 24] + +0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 1.085 +==== e( 4) = -2.74636 eV ==== + psi = 0.237*[# 1]+0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25] + +0.026*[# 5]+0.026*[# 13]+0.026*[# 29]+0.017*[# 7]+0.017*[# 16] + +0.017*[# 30]+0.016*[# 6]+0.016*[# 8]+0.016*[# 14]+0.016*[# 15] + +0.016*[# 31]+0.016*[# 32]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 18]+0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23] + +0.016*[# 24]+0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.014*[# 2] + +0.014*[# 3]+0.014*[# 4] + |psi|^2 = 1.014 +==== e( 5) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.019*[# 10]+0.019*[# 11]+0.019*[# 12]+0.019*[# 18] + +0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23]+0.019*[# 24] + +0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4] + +0.022*[# 6]+0.022*[# 8]+0.022*[# 14]+0.022*[# 15]+0.022*[# 31] + +0.022*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.013*[# 7]+0.013*[# 16] + +0.013*[# 30] + |psi|^2 = 1.022 +==== e( 7) = -0.41176 eV ==== + psi = 0.204*[# 1]+0.068*[# 9]+0.068*[# 17]+0.068*[# 21]+0.068*[# 25] + +0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.022*[# 7]+0.022*[# 16] + +0.022*[# 30]+0.015*[# 10]+0.015*[# 11]+0.015*[# 12]+0.015*[# 18] + +0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24] + +0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.014*[# 6]+0.014*[# 8] + +0.014*[# 14]+0.014*[# 15]+0.014*[# 31]+0.014*[# 32]+0.009*[# 2] + +0.009*[# 3]+0.009*[# 4] + |psi|^2 = 0.896 +==== e( 8) = 2.48448 eV ==== + psi = 0.052*[# 6]+0.052*[# 8]+0.052*[# 14]+0.052*[# 15]+0.052*[# 31] + +0.052*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.025*[# 7]+0.025*[# 16] + +0.025*[# 30]+0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.927 +==== e( 9) = 2.48448 eV ==== + psi = 0.056*[# 6]+0.056*[# 8]+0.056*[# 14]+0.056*[# 15]+0.056*[# 31] + +0.056*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.029*[# 7]+0.029*[# 16] + +0.029*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.48501 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.053*[# 7]+0.053*[# 16] + +0.053*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.009*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.000 +==== e( 11) = 3.58915 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.985 +==== e( 12) = 3.58971 eV ==== + psi = 0.084*[# 2]+0.084*[# 3]+0.084*[# 4]+0.060*[# 7]+0.060*[# 16] + +0.060*[# 30]+0.046*[# 10]+0.046*[# 11]+0.046*[# 12]+0.046*[# 18] + +0.046*[# 19]+0.046*[# 20]+0.046*[# 22]+0.046*[# 23]+0.046*[# 24] + +0.046*[# 26]+0.046*[# 27]+0.046*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.108 +==== e( 13) = 3.58971 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 7]+0.062*[# 16] + +0.062*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 3.76658 eV ==== + psi = 0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.036*[# 6]+0.036*[# 8] + +0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 14]+0.036*[# 15] + +0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23] + +0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.036*[# 31] + +0.036*[# 32]+0.028*[# 1]+0.028*[# 5]+0.028*[# 9]+0.028*[# 13] + +0.028*[# 17]+0.028*[# 21]+0.028*[# 25]+0.028*[# 29]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30] + |psi|^2 = 1.081 +==== e( 15) = 5.71627 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.046*[# 6]+0.046*[# 7] + +0.046*[# 8]+0.046*[# 10]+0.046*[# 11]+0.046*[# 12]+0.046*[# 14] + +0.046*[# 15]+0.046*[# 16]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.046*[# 30]+0.046*[# 31]+0.046*[# 32] + |psi|^2 = 1.104 +==== e( 16) = 5.71627 eV ==== + psi = 0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.029*[# 6]+0.029*[# 7] + +0.029*[# 8]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14] + +0.029*[# 15]+0.029*[# 16]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.029*[# 30]+0.029*[# 31]+0.029*[# 32] + |psi|^2 = 0.699 + + k = 0.0000000000 0.3333333333 0.1666666667 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.983 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.708 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.911 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.021*[# 6]+0.021*[# 7]+0.021*[# 8]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 14]+0.021*[# 15]+0.021*[# 16] + +0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23] + +0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.021*[# 30] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.053 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 6]+0.032*[# 7]+0.032*[# 8]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15]+0.032*[# 16] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 30] + +0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.259 +==== e( 8) = 1.85450 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32] + |psi|^2 = 0.789 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.050*[# 6]+0.050*[# 14]+0.050*[# 32]+0.050*[# 2]+0.050*[# 3] + +0.050*[# 4]+0.050*[# 7]+0.050*[# 15]+0.050*[# 8]+0.050*[# 10] + +0.050*[# 11]+0.050*[# 12]+0.050*[# 28]+0.050*[# 31]+0.050*[# 16] + +0.050*[# 18]+0.050*[# 19]+0.050*[# 20]+0.050*[# 22]+0.050*[# 23] + +0.050*[# 24]+0.050*[# 26]+0.050*[# 27]+0.050*[# 30] + |psi|^2 = 1.198 +==== e( 11) = 3.29155 eV ==== + psi = 0.035*[# 7]+0.035*[# 16]+0.035*[# 30]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23] + +0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.865 +==== e( 12) = 3.36033 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 6]+0.035*[# 7] + +0.035*[# 8]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 16]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.035*[# 30]+0.035*[# 31]+0.035*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.846 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.026*[# 6]+0.026*[# 7] + +0.026*[# 8]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 14] + +0.026*[# 15]+0.026*[# 16]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20] + +0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27] + +0.026*[# 28]+0.026*[# 30]+0.026*[# 31]+0.026*[# 32] + |psi|^2 = 0.634 +==== e( 15) = 4.50839 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.050*[# 6]+0.050*[# 7] + +0.050*[# 8]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 14] + +0.050*[# 15]+0.050*[# 16]+0.050*[# 18]+0.050*[# 19]+0.050*[# 20] + +0.050*[# 22]+0.050*[# 23]+0.050*[# 24]+0.050*[# 26]+0.050*[# 27] + +0.050*[# 28]+0.050*[# 30]+0.050*[# 31]+0.050*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.248 +==== e( 16) = 5.45761 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.818 + + k = 0.1666666667 0.3333333333 0.1666666667 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 1.011 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30]+0.008*[# 2]+0.008*[# 3]+0.008*[# 4]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20] + +0.008*[# 22]+0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27] + +0.008*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.855 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.048*[# 6]+0.048*[# 8]+0.048*[# 14]+0.048*[# 15]+0.048*[# 31] + +0.048*[# 32]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.034*[# 7]+0.034*[# 16] + +0.034*[# 30]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.883 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30] + |psi|^2 = 1.086 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.022*[# 2]+0.022*[# 3] + +0.022*[# 4]+0.018*[# 7]+0.018*[# 16]+0.018*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.948 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.034*[# 7]+0.034*[# 16]+0.034*[# 30]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 31] + +0.032*[# 32]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + |psi|^2 = 0.760 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.303 + + k = 0.3333333333 0.3333333333 0.1666666667 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4] + +0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30] + |psi|^2 = 1.070 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.004*[# 2] + +0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20] + +0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27] + +0.011*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.975 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.035*[# 2]+0.035*[# 3]+0.035*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.021*[# 31]+0.021*[# 32]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.925 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.029*[# 7] + +0.029*[# 16]+0.029*[# 30]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.922 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.026*[# 7]+0.026*[# 16]+0.026*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.868 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 6]+0.052*[# 8]+0.052*[# 14]+0.052*[# 15]+0.052*[# 31] + +0.052*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.036*[# 6]+0.036*[# 8]+0.036*[# 14]+0.036*[# 15]+0.036*[# 31] + +0.036*[# 32]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + |psi|^2 = 0.937 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.066*[# 7]+0.066*[# 16]+0.066*[# 30]+0.066*[# 2]+0.066*[# 3] + +0.066*[# 4]+0.055*[# 10]+0.055*[# 11]+0.055*[# 12]+0.055*[# 18] + +0.055*[# 19]+0.055*[# 20]+0.055*[# 22]+0.055*[# 23]+0.055*[# 24] + +0.055*[# 26]+0.055*[# 27]+0.055*[# 28]+0.044*[# 6]+0.044*[# 8] + +0.044*[# 14]+0.044*[# 15]+0.044*[# 31]+0.044*[# 32] + |psi|^2 = 1.330 +==== e( 15) = 4.45597 eV ==== + psi = 0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.016*[# 6]+0.016*[# 7] + +0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 14] + +0.016*[# 15]+0.016*[# 16]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 30]+0.016*[# 31]+0.016*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.450 +==== e( 16) = 5.48297 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 6]+0.062*[# 7] + +0.062*[# 8]+0.062*[# 10]+0.062*[# 11]+0.062*[# 12]+0.062*[# 14] + +0.062*[# 15]+0.062*[# 16]+0.062*[# 18]+0.062*[# 19]+0.062*[# 20] + +0.062*[# 22]+0.062*[# 23]+0.062*[# 24]+0.062*[# 26]+0.062*[# 27] + +0.062*[# 28]+0.062*[# 30]+0.062*[# 31]+0.062*[# 32] + |psi|^2 = 1.479 + + k = 0.5000000000 0.3333333333 0.1666666667 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28] + |psi|^2 = 1.152 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4] + |psi|^2 = 0.948 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12] + +0.017*[# 18]+0.017*[# 19]+0.017*[# 20]+0.017*[# 22]+0.017*[# 23] + +0.017*[# 24]+0.017*[# 26]+0.017*[# 27]+0.017*[# 28]+0.013*[# 2] + +0.013*[# 3]+0.013*[# 4] + |psi|^2 = 1.106 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.024*[# 6]+0.024*[# 8]+0.024*[# 14]+0.024*[# 15] + +0.024*[# 31]+0.024*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.004*[# 7] + +0.004*[# 16]+0.004*[# 30] + |psi|^2 = 0.859 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.042*[# 7]+0.042*[# 16]+0.042*[# 30] + +0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.019*[# 1] + |psi|^2 = 1.020 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.022*[# 10] + +0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20] + +0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27] + +0.022*[# 28]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 0.888 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.030*[# 7]+0.030*[# 16] + +0.030*[# 30]+0.029*[# 1]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.023*[# 6] + +0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.760 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31] + +0.027*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.954 +==== e( 12) = 3.70168 eV ==== + psi = 0.034*[# 6]+0.034*[# 8]+0.034*[# 14]+0.034*[# 15]+0.034*[# 31] + +0.034*[# 32]+0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12] + +0.025*[# 18]+0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23] + +0.025*[# 24]+0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.722 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.073*[# 2]+0.073*[# 3]+0.073*[# 4]+0.071*[# 6]+0.071*[# 8] + +0.071*[# 14]+0.071*[# 15]+0.071*[# 31]+0.071*[# 32]+0.057*[# 10] + +0.057*[# 11]+0.057*[# 12]+0.057*[# 18]+0.057*[# 19]+0.057*[# 20] + +0.057*[# 22]+0.057*[# 23]+0.057*[# 24]+0.057*[# 26]+0.057*[# 27] + +0.057*[# 28]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.002*[# 1] + + |psi|^2 = 1.371 +==== e( 15) = 4.84656 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.977 +==== e( 16) = 4.84692 eV ==== + psi = 0.068*[# 6]+0.068*[# 8]+0.068*[# 14]+0.068*[# 15]+0.068*[# 31] + +0.068*[# 32]+0.056*[# 10]+0.056*[# 11]+0.056*[# 12]+0.056*[# 18] + +0.056*[# 19]+0.056*[# 20]+0.056*[# 22]+0.056*[# 23]+0.056*[# 24] + +0.056*[# 26]+0.056*[# 27]+0.056*[# 28]+0.049*[# 2]+0.049*[# 3] + +0.049*[# 4]+0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.358 + + k = 0.6666666667 0.3333333333 0.1666666667 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4] + +0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30] + |psi|^2 = 1.070 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.004*[# 2] + +0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20] + +0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27] + +0.011*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.975 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.035*[# 2]+0.035*[# 3]+0.035*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.021*[# 31]+0.021*[# 32]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.925 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.029*[# 7] + +0.029*[# 16]+0.029*[# 30]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.922 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.026*[# 7]+0.026*[# 16]+0.026*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.868 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 6]+0.052*[# 8]+0.052*[# 14]+0.052*[# 15]+0.052*[# 31] + +0.052*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.036*[# 6]+0.036*[# 8]+0.036*[# 14]+0.036*[# 15]+0.036*[# 31] + +0.036*[# 32]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + |psi|^2 = 0.937 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.066*[# 7]+0.066*[# 16]+0.066*[# 30]+0.066*[# 2]+0.066*[# 3] + +0.066*[# 4]+0.055*[# 10]+0.055*[# 11]+0.055*[# 12]+0.055*[# 18] + +0.055*[# 19]+0.055*[# 20]+0.055*[# 22]+0.055*[# 23]+0.055*[# 24] + +0.055*[# 26]+0.055*[# 27]+0.055*[# 28]+0.044*[# 6]+0.044*[# 8] + +0.044*[# 14]+0.044*[# 15]+0.044*[# 31]+0.044*[# 32] + |psi|^2 = 1.330 +==== e( 15) = 4.45597 eV ==== + psi = 0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.016*[# 6]+0.016*[# 7] + +0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 14] + +0.016*[# 15]+0.016*[# 16]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 30]+0.016*[# 31]+0.016*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.450 +==== e( 16) = 5.48297 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 6]+0.062*[# 7] + +0.062*[# 8]+0.062*[# 10]+0.062*[# 11]+0.062*[# 12]+0.062*[# 14] + +0.062*[# 15]+0.062*[# 16]+0.062*[# 18]+0.062*[# 19]+0.062*[# 20] + +0.062*[# 22]+0.062*[# 23]+0.062*[# 24]+0.062*[# 26]+0.062*[# 27] + +0.062*[# 28]+0.062*[# 30]+0.062*[# 31]+0.062*[# 32] + |psi|^2 = 1.479 + + k = 0.8333333333 0.3333333333 0.1666666667 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 1.011 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30]+0.008*[# 2]+0.008*[# 3]+0.008*[# 4]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20] + +0.008*[# 22]+0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27] + +0.008*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.855 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.048*[# 6]+0.048*[# 8]+0.048*[# 14]+0.048*[# 15]+0.048*[# 31] + +0.048*[# 32]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.034*[# 7]+0.034*[# 16] + +0.034*[# 30]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.883 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30] + |psi|^2 = 1.086 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.022*[# 2]+0.022*[# 3] + +0.022*[# 4]+0.018*[# 7]+0.018*[# 16]+0.018*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.948 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.034*[# 7]+0.034*[# 16]+0.034*[# 30]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 31] + +0.032*[# 32]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + |psi|^2 = 0.760 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.303 + + k = 0.0000000000 0.5000000000 0.1666666667 +==== e( 1) = -4.63271 eV ==== + psi = 0.120*[# 5]+0.120*[# 13]+0.120*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.001*[# 6]+0.001*[# 8]+0.001*[# 14]+0.001*[# 15]+0.001*[# 31] + +0.001*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.63166 eV ==== + psi = 0.180*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20] + +0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27] + +0.011*[# 28] + |psi|^2 = 0.974 +==== e( 3) = -2.29294 eV ==== + psi = 0.110*[# 5]+0.110*[# 13]+0.110*[# 29]+0.082*[# 9]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4] + +0.007*[# 10]+0.007*[# 11]+0.007*[# 12]+0.007*[# 18]+0.007*[# 19] + +0.007*[# 20]+0.007*[# 22]+0.007*[# 23]+0.007*[# 24]+0.007*[# 26] + +0.007*[# 27]+0.007*[# 28]+0.006*[# 6]+0.006*[# 8]+0.006*[# 14] + +0.006*[# 15]+0.006*[# 31]+0.006*[# 32]+0.002*[# 7]+0.002*[# 16] + +0.002*[# 30] + |psi|^2 = 0.817 +==== e( 4) = -2.29202 eV ==== + psi = 0.164*[# 1]+0.082*[# 9]+0.082*[# 17]+0.082*[# 21]+0.082*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.010*[# 7]+0.010*[# 16] + +0.010*[# 30]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32]+0.006*[# 10]+0.006*[# 11]+0.006*[# 12] + +0.006*[# 18]+0.006*[# 19]+0.006*[# 20]+0.006*[# 22]+0.006*[# 23] + +0.006*[# 24]+0.006*[# 26]+0.006*[# 27]+0.006*[# 28] + |psi|^2 = 0.799 +==== e( 5) = -0.76680 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19] + +0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26] + +0.018*[# 27]+0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.994 +==== e( 6) = -0.76629 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.022*[# 10] + +0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20] + +0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27] + +0.022*[# 28]+0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.021*[# 7] + +0.021*[# 16]+0.021*[# 30] + |psi|^2 = 1.088 +==== e( 7) = 1.89706 eV ==== + psi = 0.052*[# 6]+0.052*[# 8]+0.052*[# 14]+0.052*[# 15]+0.052*[# 31] + +0.052*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.003*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.910 +==== e( 8) = 1.89734 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.050*[# 7]+0.050*[# 16] + +0.050*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 1.004 +==== e( 9) = 2.23554 eV ==== + psi = 0.103*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15]+0.040*[# 31] + +0.040*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.987 +==== e( 10) = 2.23572 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.042*[# 2]+0.042*[# 3]+0.042*[# 4] + +0.041*[# 7]+0.041*[# 16]+0.041*[# 30]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20]+0.026*[# 22] + +0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27]+0.026*[# 28] + +0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15]+0.009*[# 31] + +0.009*[# 32] + |psi|^2 = 1.024 +==== e( 11) = 3.04468 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.040*[# 7]+0.040*[# 16] + +0.040*[# 30]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.011*[# 6]+0.011*[# 8] + +0.011*[# 14]+0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.688 +==== e( 12) = 3.04476 eV ==== + psi = 0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.016*[# 7]+0.016*[# 16] + +0.016*[# 30]+0.010*[# 2]+0.010*[# 3]+0.010*[# 4]+0.002*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.725 +==== e( 13) = 3.80535 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.989 +==== e( 14) = 3.80571 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.049*[# 10]+0.049*[# 11]+0.049*[# 12]+0.049*[# 18] + +0.049*[# 19]+0.049*[# 20]+0.049*[# 22]+0.049*[# 23]+0.049*[# 24] + +0.049*[# 26]+0.049*[# 27]+0.049*[# 28]+0.045*[# 6]+0.045*[# 8] + +0.045*[# 14]+0.045*[# 15]+0.045*[# 31]+0.045*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 1.216 +==== e( 15) = 4.52337 eV ==== + psi = 0.043*[# 7]+0.043*[# 16]+0.043*[# 30]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 18] + +0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23]+0.032*[# 24] + +0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.787 +==== e( 16) = 4.52360 eV ==== + psi = 0.049*[# 6]+0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 31] + +0.049*[# 32]+0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30]+0.006*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 1.014 + + k = 0.1666666667 0.5000000000 0.1666666667 +==== e( 1) = -4.52498 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.52394 eV ==== + psi = 0.179*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.002*[# 2]+0.002*[# 3]+0.002*[# 4]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.993 +==== e( 3) = -2.53521 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.875 +==== e( 4) = -2.53429 eV ==== + psi = 0.172*[# 1]+0.086*[# 9]+0.086*[# 17]+0.086*[# 21]+0.086*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.008*[# 7]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12] + +0.008*[# 16]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.008*[# 30]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.875 +==== e( 5) = -0.69955 eV ==== + psi = 0.078*[# 5]+0.078*[# 13]+0.078*[# 29]+0.059*[# 9]+0.059*[# 17] + +0.059*[# 21]+0.059*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.69934 eV ==== + psi = 0.117*[# 1]+0.059*[# 9]+0.059*[# 17]+0.059*[# 21]+0.059*[# 25] + +0.039*[# 5]+0.039*[# 13]+0.039*[# 29]+0.025*[# 2]+0.025*[# 3] + +0.025*[# 4]+0.025*[# 7]+0.025*[# 16]+0.025*[# 30]+0.022*[# 10] + +0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20] + +0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27] + +0.022*[# 28]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 7) = 1.70960 eV ==== + psi = 0.051*[# 5]+0.051*[# 13]+0.051*[# 29]+0.048*[# 7]+0.048*[# 16] + +0.048*[# 30]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.029*[# 1]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.020*[# 2] + +0.020*[# 3]+0.020*[# 4] + |psi|^2 = 1.035 +==== e( 8) = 1.71009 eV ==== + psi = 0.062*[# 1]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.028*[# 10] + +0.028*[# 11]+0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4]+0.021*[# 7] + +0.021*[# 16]+0.021*[# 30] + |psi|^2 = 1.035 +==== e( 9) = 2.10371 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.10436 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.050*[# 7]+0.050*[# 16] + +0.050*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.017*[# 1] + +0.009*[# 9]+0.009*[# 17]+0.009*[# 21]+0.009*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 0.993 +==== e( 11) = 3.36740 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30] + |psi|^2 = 1.043 +==== e( 12) = 3.36742 eV ==== + psi = 0.067*[# 2]+0.067*[# 3]+0.067*[# 4]+0.056*[# 7]+0.056*[# 16] + +0.056*[# 30]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.001*[# 1] + + |psi|^2 = 1.043 +==== e( 13) = 4.14946 eV ==== + psi = 0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.028*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.988 +==== e( 14) = 4.14988 eV ==== + psi = 0.047*[# 2]+0.047*[# 3]+0.047*[# 4]+0.047*[# 7]+0.047*[# 16] + +0.047*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.002*[# 1] + |psi|^2 = 0.988 +==== e( 15) = 4.40345 eV ==== + psi = 0.042*[# 7]+0.042*[# 16]+0.042*[# 30]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.030*[# 31] + +0.030*[# 32]+0.019*[# 2]+0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.728 +==== e( 16) = 4.40456 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.030*[# 31] + +0.030*[# 32] + |psi|^2 = 0.728 + + k = 0.3333333333 0.5000000000 0.1666666667 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 1.038 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4] + |psi|^2 = 0.948 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12] + +0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23] + +0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.004*[# 7] + +0.004*[# 16]+0.004*[# 30] + |psi|^2 = 0.992 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.017*[# 7] + +0.017*[# 16]+0.017*[# 30] + |psi|^2 = 0.895 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.042*[# 7]+0.042*[# 16]+0.042*[# 30] + +0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.019*[# 1] + |psi|^2 = 1.020 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.031*[# 2] + +0.031*[# 3]+0.031*[# 4]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.001*[# 7] + +0.001*[# 16]+0.001*[# 30] + |psi|^2 = 0.923 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.032*[# 7]+0.032*[# 16] + +0.032*[# 30]+0.029*[# 1]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12] + +0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23] + +0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.024*[# 6] + +0.024*[# 8]+0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.789 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31] + +0.027*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.954 +==== e( 12) = 3.70168 eV ==== + psi = 0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.028*[# 1]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.023*[# 2] + +0.023*[# 3]+0.023*[# 4]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.750 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.068*[# 6]+0.068*[# 8]+0.068*[# 14]+0.068*[# 15]+0.068*[# 31] + +0.068*[# 32]+0.054*[# 10]+0.054*[# 11]+0.054*[# 12]+0.054*[# 18] + +0.054*[# 19]+0.054*[# 20]+0.054*[# 22]+0.054*[# 23]+0.054*[# 24] + +0.054*[# 26]+0.054*[# 27]+0.054*[# 28]+0.040*[# 2]+0.040*[# 3] + +0.040*[# 4]+0.040*[# 7]+0.040*[# 16]+0.040*[# 30]+0.002*[# 1] + + |psi|^2 = 1.302 +==== e( 15) = 4.84656 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.977 +==== e( 16) = 4.84692 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.065*[# 6]+0.065*[# 8] + +0.065*[# 14]+0.065*[# 15]+0.065*[# 31]+0.065*[# 32]+0.053*[# 10] + +0.053*[# 11]+0.053*[# 12]+0.053*[# 18]+0.053*[# 19]+0.053*[# 20] + +0.053*[# 22]+0.053*[# 23]+0.053*[# 24]+0.053*[# 26]+0.053*[# 27] + +0.053*[# 28]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.290 + + k = 0.5000000000 0.5000000000 0.1666666667 +==== e( 1) = -3.71242 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19] + +0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26] + +0.012*[# 27]+0.012*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.71222 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 2]+0.021*[# 3]+0.021*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.015*[# 10]+0.015*[# 11]+0.015*[# 12]+0.015*[# 18] + +0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24] + +0.015*[# 26]+0.015*[# 27]+0.015*[# 28] + |psi|^2 = 1.078 +==== e( 3) = -3.71222 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 2]+0.021*[# 3]+0.021*[# 4] + +0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15]+0.014*[# 31] + +0.014*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + |psi|^2 = 0.994 +==== e( 4) = -3.71037 eV ==== + psi = 0.353*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15]+0.019*[# 31] + +0.019*[# 32]+0.015*[# 10]+0.015*[# 11]+0.015*[# 12]+0.015*[# 18] + +0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24] + +0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30] + |psi|^2 = 1.077 +==== e( 5) = 0.12722 eV ==== + psi = 0.098*[# 7]+0.098*[# 16]+0.098*[# 30]+0.045*[# 5]+0.045*[# 13] + +0.045*[# 29]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.041*[# 1]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 0.991 +==== e( 6) = 0.12772 eV ==== + psi = 0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.029*[# 2]+0.029*[# 3]+0.029*[# 4] + +0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + |psi|^2 = 0.883 +==== e( 7) = 0.12772 eV ==== + psi = 0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.038*[# 6]+0.038*[# 8]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 31]+0.038*[# 32]+0.029*[# 2]+0.029*[# 3] + +0.029*[# 4]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + |psi|^2 = 0.991 +==== e( 8) = 0.12828 eV ==== + psi = 0.135*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4]+0.022*[# 10] + +0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20] + +0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27] + +0.022*[# 28]+0.014*[# 5]+0.014*[# 13]+0.014*[# 29]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.883 +==== e( 9) = 3.08095 eV ==== + psi = 0.122*[# 7]+0.122*[# 16]+0.122*[# 30]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.020*[# 5]+0.020*[# 13]+0.020*[# 29]+0.016*[# 9]+0.016*[# 17] + +0.016*[# 21]+0.016*[# 25]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14] + +0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.001*[# 1] + |psi|^2 = 0.991 +==== e( 10) = 3.08168 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.021*[# 5]+0.021*[# 13]+0.021*[# 29]+0.016*[# 9] + +0.016*[# 17]+0.016*[# 21]+0.016*[# 25] + |psi|^2 = 0.703 +==== e( 11) = 3.08168 eV ==== + psi = 0.056*[# 6]+0.056*[# 8]+0.056*[# 14]+0.056*[# 15]+0.056*[# 31] + +0.056*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.021*[# 5]+0.021*[# 13]+0.021*[# 29]+0.016*[# 9] + +0.016*[# 17]+0.016*[# 21]+0.016*[# 25] + |psi|^2 = 0.991 +==== e( 12) = 3.08237 eV ==== + psi = 0.061*[# 1]+0.048*[# 7]+0.048*[# 16]+0.048*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.022*[# 6]+0.022*[# 8]+0.022*[# 14]+0.022*[# 15] + +0.022*[# 31]+0.022*[# 32]+0.016*[# 9]+0.016*[# 17]+0.016*[# 21] + +0.016*[# 25]+0.004*[# 2]+0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.703 +==== e( 13) = 4.86024 eV ==== + psi = 0.164*[# 7]+0.164*[# 16]+0.164*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.988 +==== e( 14) = 4.86071 eV ==== + psi = 0.123*[# 6]+0.123*[# 8]+0.123*[# 14]+0.123*[# 15]+0.123*[# 31] + +0.123*[# 32]+0.062*[# 10]+0.062*[# 11]+0.062*[# 12]+0.062*[# 18] + +0.062*[# 19]+0.062*[# 20]+0.062*[# 22]+0.062*[# 23]+0.062*[# 24] + +0.062*[# 26]+0.062*[# 27]+0.062*[# 28] + |psi|^2 = 1.483 +==== e( 15) = 4.86155 eV ==== + psi = 0.082*[# 2]+0.082*[# 3]+0.082*[# 4]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14]+0.041*[# 15] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.041*[# 31] + +0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 4.86155 eV ==== + psi = 0.082*[# 2]+0.082*[# 3]+0.082*[# 4]+0.082*[# 6]+0.082*[# 8] + +0.082*[# 14]+0.082*[# 15]+0.082*[# 31]+0.082*[# 32]+0.062*[# 10] + +0.062*[# 11]+0.062*[# 12]+0.062*[# 18]+0.062*[# 19]+0.062*[# 20] + +0.062*[# 22]+0.062*[# 23]+0.062*[# 24]+0.062*[# 26]+0.062*[# 27] + +0.062*[# 28] + |psi|^2 = 1.483 + + k = 0.6666666667 0.5000000000 0.1666666667 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 1.038 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4] + |psi|^2 = 0.948 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12] + +0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23] + +0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.004*[# 7] + +0.004*[# 16]+0.004*[# 30] + |psi|^2 = 0.992 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.017*[# 7] + +0.017*[# 16]+0.017*[# 30] + |psi|^2 = 0.894 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.042*[# 7]+0.042*[# 16]+0.042*[# 30] + +0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.019*[# 1] + |psi|^2 = 1.020 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.031*[# 2] + +0.031*[# 3]+0.031*[# 4]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.001*[# 7] + +0.001*[# 16]+0.001*[# 30] + |psi|^2 = 0.923 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.032*[# 7]+0.032*[# 16] + +0.032*[# 30]+0.029*[# 1]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12] + +0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23] + +0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.024*[# 6] + +0.024*[# 8]+0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.789 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31] + +0.027*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.954 +==== e( 12) = 3.70168 eV ==== + psi = 0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.028*[# 1]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.023*[# 2] + +0.023*[# 3]+0.023*[# 4]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.750 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.068*[# 6]+0.068*[# 8]+0.068*[# 14]+0.068*[# 15]+0.068*[# 31] + +0.068*[# 32]+0.054*[# 10]+0.054*[# 11]+0.054*[# 12]+0.054*[# 18] + +0.054*[# 19]+0.054*[# 20]+0.054*[# 22]+0.054*[# 23]+0.054*[# 24] + +0.054*[# 26]+0.054*[# 27]+0.054*[# 28]+0.040*[# 2]+0.040*[# 3] + +0.040*[# 4]+0.040*[# 7]+0.040*[# 16]+0.040*[# 30]+0.002*[# 1] + + |psi|^2 = 1.302 +==== e( 15) = 4.84656 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.977 +==== e( 16) = 4.84692 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.065*[# 6]+0.065*[# 8] + +0.065*[# 14]+0.065*[# 15]+0.065*[# 31]+0.065*[# 32]+0.053*[# 10] + +0.053*[# 11]+0.053*[# 12]+0.053*[# 18]+0.053*[# 19]+0.053*[# 20] + +0.053*[# 22]+0.053*[# 23]+0.053*[# 24]+0.053*[# 26]+0.053*[# 27] + +0.053*[# 28]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.290 + + k = 0.8333333333 0.5000000000 0.1666666667 +==== e( 1) = -4.52498 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.52394 eV ==== + psi = 0.179*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.002*[# 2]+0.002*[# 3]+0.002*[# 4]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.993 +==== e( 3) = -2.53521 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.875 +==== e( 4) = -2.53429 eV ==== + psi = 0.172*[# 1]+0.086*[# 9]+0.086*[# 17]+0.086*[# 21]+0.086*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.008*[# 7]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12] + +0.008*[# 16]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.008*[# 30]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.875 +==== e( 5) = -0.69955 eV ==== + psi = 0.078*[# 5]+0.078*[# 13]+0.078*[# 29]+0.059*[# 9]+0.059*[# 17] + +0.059*[# 21]+0.059*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.69934 eV ==== + psi = 0.117*[# 1]+0.059*[# 9]+0.059*[# 17]+0.059*[# 21]+0.059*[# 25] + +0.039*[# 5]+0.039*[# 13]+0.039*[# 29]+0.025*[# 2]+0.025*[# 3] + +0.025*[# 4]+0.025*[# 7]+0.025*[# 16]+0.025*[# 30]+0.022*[# 10] + +0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20] + +0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27] + +0.022*[# 28]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 7) = 1.70960 eV ==== + psi = 0.051*[# 5]+0.051*[# 13]+0.051*[# 29]+0.048*[# 7]+0.048*[# 16] + +0.048*[# 30]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.029*[# 1]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.020*[# 2] + +0.020*[# 3]+0.020*[# 4] + |psi|^2 = 1.035 +==== e( 8) = 1.71009 eV ==== + psi = 0.062*[# 1]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.028*[# 10] + +0.028*[# 11]+0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4]+0.021*[# 7] + +0.021*[# 16]+0.021*[# 30] + |psi|^2 = 1.035 +==== e( 9) = 2.10371 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.10436 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.050*[# 7]+0.050*[# 16] + +0.050*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.017*[# 1] + +0.009*[# 9]+0.009*[# 17]+0.009*[# 21]+0.009*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 0.993 +==== e( 11) = 3.36740 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30] + |psi|^2 = 1.043 +==== e( 12) = 3.36742 eV ==== + psi = 0.067*[# 2]+0.067*[# 3]+0.067*[# 4]+0.056*[# 7]+0.056*[# 16] + +0.056*[# 30]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.001*[# 1] + + |psi|^2 = 1.043 +==== e( 13) = 4.14946 eV ==== + psi = 0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.028*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.988 +==== e( 14) = 4.14988 eV ==== + psi = 0.047*[# 2]+0.047*[# 3]+0.047*[# 4]+0.047*[# 7]+0.047*[# 16] + +0.047*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.002*[# 1] + |psi|^2 = 0.988 +==== e( 15) = 4.40345 eV ==== + psi = 0.042*[# 7]+0.042*[# 16]+0.042*[# 30]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.030*[# 31] + +0.030*[# 32]+0.019*[# 2]+0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.728 +==== e( 16) = 4.40456 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.030*[# 31] + +0.030*[# 32] + |psi|^2 = 0.728 + + k = 0.0000000000 0.6666666667 0.1666666667 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.983 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.708 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.911 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.021*[# 6]+0.021*[# 7]+0.021*[# 8]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 14]+0.021*[# 15]+0.021*[# 16] + +0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23] + +0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.021*[# 30] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.053 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 6]+0.032*[# 7]+0.032*[# 8]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15]+0.032*[# 16] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 30] + +0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.259 +==== e( 8) = 1.85450 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32] + |psi|^2 = 0.789 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.050*[# 6]+0.050*[# 7] + +0.050*[# 8]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 14] + +0.050*[# 15]+0.050*[# 16]+0.050*[# 18]+0.050*[# 19]+0.050*[# 20] + +0.050*[# 22]+0.050*[# 23]+0.050*[# 24]+0.050*[# 26]+0.050*[# 27] + +0.050*[# 28]+0.050*[# 30]+0.050*[# 31]+0.050*[# 32] + |psi|^2 = 1.198 +==== e( 11) = 3.29155 eV ==== + psi = 0.035*[# 7]+0.035*[# 16]+0.035*[# 30]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23] + +0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.865 +==== e( 12) = 3.36033 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 6]+0.035*[# 7] + +0.035*[# 8]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 16]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.035*[# 30]+0.035*[# 31]+0.035*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.846 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.026*[# 6]+0.026*[# 7] + +0.026*[# 8]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 14] + +0.026*[# 15]+0.026*[# 16]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20] + +0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27] + +0.026*[# 28]+0.026*[# 30]+0.026*[# 31]+0.026*[# 32] + |psi|^2 = 0.634 +==== e( 15) = 4.50839 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.050*[# 6]+0.050*[# 7] + +0.050*[# 8]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 14] + +0.050*[# 15]+0.050*[# 16]+0.050*[# 18]+0.050*[# 19]+0.050*[# 20] + +0.050*[# 22]+0.050*[# 23]+0.050*[# 24]+0.050*[# 26]+0.050*[# 27] + +0.050*[# 28]+0.050*[# 30]+0.050*[# 31]+0.050*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.248 +==== e( 16) = 5.45761 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.818 + + k = 0.1666666667 0.6666666667 0.1666666667 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 1.011 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30]+0.008*[# 2]+0.008*[# 3]+0.008*[# 4]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20] + +0.008*[# 22]+0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27] + +0.008*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.855 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.048*[# 6]+0.048*[# 8]+0.048*[# 14]+0.048*[# 15]+0.048*[# 31] + +0.048*[# 32]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.034*[# 7]+0.034*[# 16] + +0.034*[# 30]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.883 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30] + |psi|^2 = 1.086 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.022*[# 2]+0.022*[# 3] + +0.022*[# 4]+0.018*[# 7]+0.018*[# 16]+0.018*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.948 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.034*[# 7]+0.034*[# 16]+0.034*[# 30]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 31] + +0.032*[# 32]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + |psi|^2 = 0.760 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.303 + + k = 0.3333333333 0.6666666667 0.1666666667 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4] + +0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30] + |psi|^2 = 1.070 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.004*[# 2] + +0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20] + +0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27] + +0.011*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.975 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.035*[# 2]+0.035*[# 3]+0.035*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.021*[# 31]+0.021*[# 32]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.925 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.029*[# 7] + +0.029*[# 16]+0.029*[# 30]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.922 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.026*[# 7]+0.026*[# 16]+0.026*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.868 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 6]+0.052*[# 8]+0.052*[# 14]+0.052*[# 15]+0.052*[# 31] + +0.052*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.036*[# 6]+0.036*[# 8]+0.036*[# 14]+0.036*[# 15]+0.036*[# 31] + +0.036*[# 32]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + |psi|^2 = 0.937 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.066*[# 7]+0.066*[# 16]+0.066*[# 30]+0.066*[# 2]+0.066*[# 3] + +0.066*[# 4]+0.055*[# 10]+0.055*[# 11]+0.055*[# 12]+0.055*[# 18] + +0.055*[# 19]+0.055*[# 20]+0.055*[# 22]+0.055*[# 23]+0.055*[# 24] + +0.055*[# 26]+0.055*[# 27]+0.055*[# 28]+0.044*[# 6]+0.044*[# 8] + +0.044*[# 14]+0.044*[# 15]+0.044*[# 31]+0.044*[# 32] + |psi|^2 = 1.330 +==== e( 15) = 4.45597 eV ==== + psi = 0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.016*[# 6]+0.016*[# 7] + +0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 14] + +0.016*[# 15]+0.016*[# 16]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 30]+0.016*[# 31]+0.016*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.450 +==== e( 16) = 5.48297 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 6]+0.062*[# 7] + +0.062*[# 8]+0.062*[# 10]+0.062*[# 11]+0.062*[# 12]+0.062*[# 14] + +0.062*[# 15]+0.062*[# 16]+0.062*[# 18]+0.062*[# 19]+0.062*[# 20] + +0.062*[# 22]+0.062*[# 23]+0.062*[# 24]+0.062*[# 26]+0.062*[# 27] + +0.062*[# 28]+0.062*[# 30]+0.062*[# 31]+0.062*[# 32] + |psi|^2 = 1.479 + + k = 0.5000000000 0.6666666667 0.1666666667 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28] + |psi|^2 = 1.152 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4] + |psi|^2 = 0.948 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12] + +0.017*[# 18]+0.017*[# 19]+0.017*[# 20]+0.017*[# 22]+0.017*[# 23] + +0.017*[# 24]+0.017*[# 26]+0.017*[# 27]+0.017*[# 28]+0.013*[# 2] + +0.013*[# 3]+0.013*[# 4] + |psi|^2 = 1.106 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.024*[# 6]+0.024*[# 8]+0.024*[# 14]+0.024*[# 15] + +0.024*[# 31]+0.024*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.004*[# 7] + +0.004*[# 16]+0.004*[# 30] + |psi|^2 = 0.859 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.042*[# 7]+0.042*[# 16]+0.042*[# 30] + +0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.019*[# 1] + |psi|^2 = 1.020 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.022*[# 10] + +0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20] + +0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27] + +0.022*[# 28]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 0.888 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.030*[# 7]+0.030*[# 16] + +0.030*[# 30]+0.029*[# 1]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.023*[# 6] + +0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.760 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31] + +0.027*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.954 +==== e( 12) = 3.70168 eV ==== + psi = 0.034*[# 6]+0.034*[# 8]+0.034*[# 14]+0.034*[# 15]+0.034*[# 31] + +0.034*[# 32]+0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12] + +0.025*[# 18]+0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23] + +0.025*[# 24]+0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.722 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.073*[# 2]+0.073*[# 3]+0.073*[# 4]+0.071*[# 6]+0.071*[# 8] + +0.071*[# 14]+0.071*[# 15]+0.071*[# 31]+0.071*[# 32]+0.057*[# 10] + +0.057*[# 11]+0.057*[# 12]+0.057*[# 18]+0.057*[# 19]+0.057*[# 20] + +0.057*[# 22]+0.057*[# 23]+0.057*[# 24]+0.057*[# 26]+0.057*[# 27] + +0.057*[# 28]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.002*[# 1] + + |psi|^2 = 1.371 +==== e( 15) = 4.84656 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.977 +==== e( 16) = 4.84692 eV ==== + psi = 0.068*[# 6]+0.068*[# 8]+0.068*[# 14]+0.068*[# 15]+0.068*[# 31] + +0.068*[# 32]+0.056*[# 10]+0.056*[# 11]+0.056*[# 12]+0.056*[# 18] + +0.056*[# 19]+0.056*[# 20]+0.056*[# 22]+0.056*[# 23]+0.056*[# 24] + +0.056*[# 26]+0.056*[# 27]+0.056*[# 28]+0.049*[# 2]+0.049*[# 3] + +0.049*[# 4]+0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.358 + + k = 0.6666666667 0.6666666667 0.1666666667 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4] + +0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30] + |psi|^2 = 1.070 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.004*[# 2] + +0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20] + +0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27] + +0.011*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.975 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.035*[# 2]+0.035*[# 3]+0.035*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.021*[# 31]+0.021*[# 32]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.925 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.029*[# 7] + +0.029*[# 16]+0.029*[# 30]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.922 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.026*[# 7]+0.026*[# 16]+0.026*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.868 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 6]+0.052*[# 8]+0.052*[# 14]+0.052*[# 15]+0.052*[# 31] + +0.052*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.036*[# 6]+0.036*[# 8]+0.036*[# 14]+0.036*[# 15]+0.036*[# 31] + +0.036*[# 32]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + |psi|^2 = 0.937 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.066*[# 7]+0.066*[# 16]+0.066*[# 30]+0.066*[# 2]+0.066*[# 3] + +0.066*[# 4]+0.055*[# 10]+0.055*[# 11]+0.055*[# 12]+0.055*[# 18] + +0.055*[# 19]+0.055*[# 20]+0.055*[# 22]+0.055*[# 23]+0.055*[# 24] + +0.055*[# 26]+0.055*[# 27]+0.055*[# 28]+0.044*[# 6]+0.044*[# 8] + +0.044*[# 14]+0.044*[# 15]+0.044*[# 31]+0.044*[# 32] + |psi|^2 = 1.330 +==== e( 15) = 4.45597 eV ==== + psi = 0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.016*[# 6]+0.016*[# 7] + +0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 14] + +0.016*[# 15]+0.016*[# 16]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 30]+0.016*[# 31]+0.016*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.450 +==== e( 16) = 5.48297 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 6]+0.062*[# 7] + +0.062*[# 8]+0.062*[# 10]+0.062*[# 11]+0.062*[# 12]+0.062*[# 14] + +0.062*[# 15]+0.062*[# 16]+0.062*[# 18]+0.062*[# 19]+0.062*[# 20] + +0.062*[# 22]+0.062*[# 23]+0.062*[# 24]+0.062*[# 26]+0.062*[# 27] + +0.062*[# 28]+0.062*[# 30]+0.062*[# 31]+0.062*[# 32] + |psi|^2 = 1.479 + + k = 0.8333333333 0.6666666667 0.1666666667 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 1.011 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30]+0.008*[# 2]+0.008*[# 3]+0.008*[# 4]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20] + +0.008*[# 22]+0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27] + +0.008*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.855 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.048*[# 6]+0.048*[# 8]+0.048*[# 14]+0.048*[# 15]+0.048*[# 31] + +0.048*[# 32]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.034*[# 7]+0.034*[# 16] + +0.034*[# 30]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.883 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30] + |psi|^2 = 1.086 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.022*[# 2]+0.022*[# 3] + +0.022*[# 4]+0.018*[# 7]+0.018*[# 16]+0.018*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.948 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.034*[# 7]+0.034*[# 16]+0.034*[# 30]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 31] + +0.032*[# 32]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + |psi|^2 = 0.760 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.303 + + k = 0.0000000000 0.8333333333 0.1666666667 +==== e( 1) = -5.58652 eV ==== + psi = 0.112*[# 5]+0.112*[# 9]+0.112*[# 13]+0.112*[# 17]+0.112*[# 21] + +0.112*[# 25]+0.112*[# 29]+0.111*[# 1]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.80598 eV ==== + psi = 0.103*[# 5]+0.103*[# 13]+0.103*[# 29]+0.077*[# 9]+0.077*[# 17] + +0.077*[# 21]+0.077*[# 25]+0.009*[# 2]+0.009*[# 3]+0.009*[# 4] + +0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15]+0.008*[# 31] + +0.008*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.812 +==== e( 3) = -2.80522 eV ==== + psi = 0.155*[# 1]+0.077*[# 9]+0.077*[# 17]+0.077*[# 21]+0.077*[# 25] + +0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -1.80516 eV ==== + psi = 0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25]+0.079*[# 1] + +0.079*[# 5]+0.079*[# 13]+0.079*[# 29]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30]+0.015*[# 6]+0.015*[# 8]+0.015*[# 10]+0.015*[# 11] + +0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 18]+0.015*[# 19] + +0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26] + +0.015*[# 27]+0.015*[# 28]+0.015*[# 31]+0.015*[# 32]+0.014*[# 2] + +0.014*[# 3]+0.014*[# 4] + |psi|^2 = 0.987 +==== e( 5) = -1.40568 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 13]+0.070*[# 29]+0.069*[# 9] + +0.069*[# 17]+0.069*[# 21]+0.069*[# 25]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.34433 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.028*[# 6]+0.028*[# 8]+0.028*[# 14] + +0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20]+0.026*[# 22] + +0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27]+0.026*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.024*[# 7]+0.024*[# 16] + +0.024*[# 30] + |psi|^2 = 1.182 +==== e( 7) = -0.34382 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20] + +0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27] + +0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32] + |psi|^2 = 0.993 +==== e( 8) = 2.26764 eV ==== + psi = 0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 14]+0.026*[# 15] + +0.026*[# 18]+0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23] + +0.026*[# 24]+0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.026*[# 31] + +0.026*[# 32]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.626 +==== e( 9) = 3.00585 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 3.00589 eV ==== + psi = 0.098*[# 7]+0.098*[# 16]+0.098*[# 30]+0.051*[# 10]+0.051*[# 11] + +0.051*[# 12]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20]+0.051*[# 22] + +0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27]+0.051*[# 28] + +0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.007*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 1.243 +==== e( 11) = 3.20562 eV ==== + psi = 0.057*[# 6]+0.057*[# 8]+0.057*[# 14]+0.057*[# 15]+0.057*[# 31] + +0.057*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.948 +==== e( 12) = 3.20630 eV ==== + psi = 0.096*[# 2]+0.096*[# 3]+0.096*[# 4]+0.050*[# 10]+0.050*[# 11] + +0.050*[# 12]+0.050*[# 18]+0.050*[# 19]+0.050*[# 20]+0.050*[# 22] + +0.050*[# 23]+0.050*[# 24]+0.050*[# 26]+0.050*[# 27]+0.050*[# 28] + +0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.198 +==== e( 13) = 3.48375 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 4.56822 eV ==== + psi = 0.026*[# 1]+0.026*[# 5]+0.026*[# 9]+0.026*[# 13]+0.026*[# 17] + +0.026*[# 21]+0.026*[# 25]+0.026*[# 29]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.663 +==== e( 15) = 5.28998 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.048*[# 6]+0.048*[# 7] + +0.048*[# 8]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 14] + +0.048*[# 15]+0.048*[# 16]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.048*[# 30]+0.048*[# 31]+0.048*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.166 +==== e( 16) = 6.05492 eV ==== + psi = 0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.026*[# 6]+0.026*[# 7] + +0.026*[# 8]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 14] + +0.026*[# 15]+0.026*[# 16]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20] + +0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27] + +0.026*[# 28]+0.026*[# 30]+0.026*[# 31]+0.026*[# 32] + |psi|^2 = 0.628 + + k = 0.1666666667 0.8333333333 0.1666666667 +==== e( 1) = -5.46675 eV ==== + psi = 0.107*[# 5]+0.107*[# 9]+0.107*[# 13]+0.107*[# 17]+0.107*[# 21] + +0.107*[# 25]+0.107*[# 29]+0.107*[# 1]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4]+0.006*[# 6]+0.006*[# 7]+0.006*[# 8]+0.006*[# 10] + +0.006*[# 11]+0.006*[# 12]+0.006*[# 14]+0.006*[# 15]+0.006*[# 16] + +0.006*[# 18]+0.006*[# 19]+0.006*[# 20]+0.006*[# 22]+0.006*[# 23] + +0.006*[# 24]+0.006*[# 26]+0.006*[# 27]+0.006*[# 28]+0.006*[# 30] + +0.006*[# 31]+0.006*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.012*[# 2]+0.012*[# 3]+0.012*[# 4] + +0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15]+0.011*[# 31] + +0.011*[# 32]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12]+0.011*[# 18] + +0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24] + +0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30] + |psi|^2 = 0.896 +==== e( 3) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + +0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15]+0.017*[# 31] + +0.017*[# 32]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12]+0.017*[# 18] + +0.017*[# 19]+0.017*[# 20]+0.017*[# 22]+0.017*[# 23]+0.017*[# 24] + +0.017*[# 26]+0.017*[# 27]+0.017*[# 28]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30] + |psi|^2 = 1.038 +==== e( 4) = -2.74636 eV ==== + psi = 0.237*[# 1]+0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25] + +0.026*[# 5]+0.026*[# 13]+0.026*[# 29]+0.023*[# 7]+0.023*[# 16] + +0.023*[# 30]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18] + +0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24] + +0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.017*[# 2]+0.017*[# 3] + +0.017*[# 4]+0.016*[# 6]+0.016*[# 8]+0.016*[# 14]+0.016*[# 15] + +0.016*[# 31]+0.016*[# 32] + |psi|^2 = 1.062 +==== e( 5) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.019*[# 10]+0.019*[# 11]+0.019*[# 12]+0.019*[# 18] + +0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23]+0.019*[# 24] + +0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18] + +0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24] + +0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.013*[# 7]+0.013*[# 16] + +0.013*[# 30] + |psi|^2 = 1.049 +==== e( 7) = -0.41176 eV ==== + psi = 0.204*[# 1]+0.068*[# 9]+0.068*[# 17]+0.068*[# 21]+0.068*[# 25] + +0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.023*[# 5]+0.023*[# 13] + +0.023*[# 29]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 1.022 +==== e( 8) = 2.48448 eV ==== + psi = 0.048*[# 6]+0.048*[# 8]+0.048*[# 14]+0.048*[# 15]+0.048*[# 31] + +0.048*[# 32]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 18] + +0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23]+0.031*[# 24] + +0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.020*[# 7]+0.020*[# 16] + +0.020*[# 30]+0.010*[# 2]+0.010*[# 3]+0.010*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.780 +==== e( 9) = 2.48448 eV ==== + psi = 0.056*[# 6]+0.056*[# 8]+0.056*[# 14]+0.056*[# 15]+0.056*[# 31] + +0.056*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.029*[# 7]+0.029*[# 16] + +0.029*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.48501 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.061*[# 2]+0.061*[# 3] + +0.061*[# 4]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.009*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.993 +==== e( 11) = 3.58915 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.985 +==== e( 12) = 3.58971 eV ==== + psi = 0.068*[# 2]+0.068*[# 3]+0.068*[# 4]+0.044*[# 7]+0.044*[# 16] + +0.044*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32] + |psi|^2 = 0.982 +==== e( 13) = 3.58971 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 7]+0.062*[# 16] + +0.062*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 3.76658 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23] + +0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.028*[# 1]+0.028*[# 5]+0.028*[# 7]+0.028*[# 9] + +0.028*[# 13]+0.028*[# 16]+0.028*[# 17]+0.028*[# 21]+0.028*[# 25] + +0.028*[# 29]+0.028*[# 30] + |psi|^2 = 1.047 +==== e( 15) = 5.71627 eV ==== + psi = 0.042*[# 2]+0.042*[# 3]+0.042*[# 4]+0.042*[# 6]+0.042*[# 7] + +0.042*[# 8]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 14] + +0.042*[# 15]+0.042*[# 16]+0.042*[# 18]+0.042*[# 19]+0.042*[# 20] + +0.042*[# 22]+0.042*[# 23]+0.042*[# 24]+0.042*[# 26]+0.042*[# 27] + +0.042*[# 28]+0.042*[# 30]+0.042*[# 31]+0.042*[# 32] + |psi|^2 = 1.006 +==== e( 16) = 5.71627 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32] + |psi|^2 = 0.797 + + k = 0.3333333333 0.8333333333 0.1666666667 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.118 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.136 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.026*[# 7]+0.026*[# 16] + +0.026*[# 30]+0.015*[# 10]+0.015*[# 11]+0.015*[# 12]+0.015*[# 18] + +0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24] + +0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.012*[# 6]+0.012*[# 8] + +0.012*[# 14]+0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4] + |psi|^2 = 0.853 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.020*[# 7]+0.020*[# 16] + +0.020*[# 30]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.743 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.045*[# 2]+0.045*[# 3]+0.045*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 1.070 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.985 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23] + +0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.040*[# 31] + +0.040*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.952 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.030*[# 6]+0.030*[# 7] + +0.030*[# 8]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14] + +0.030*[# 15]+0.030*[# 16]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.030*[# 30]+0.030*[# 31]+0.030*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.807 + + k = 0.5000000000 0.8333333333 0.1666666667 +==== e( 1) = -4.52498 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.52394 eV ==== + psi = 0.179*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28] + |psi|^2 = 1.202 +==== e( 3) = -2.53521 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.875 +==== e( 4) = -2.53429 eV ==== + psi = 0.172*[# 1]+0.086*[# 9]+0.086*[# 17]+0.086*[# 21]+0.086*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12]+0.017*[# 18] + +0.017*[# 19]+0.017*[# 20]+0.017*[# 22]+0.017*[# 23]+0.017*[# 24] + +0.017*[# 26]+0.017*[# 27]+0.017*[# 28]+0.016*[# 6]+0.016*[# 8] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 31]+0.016*[# 32]+0.008*[# 2] + +0.008*[# 3]+0.008*[# 4] + |psi|^2 = 1.084 +==== e( 5) = -0.69955 eV ==== + psi = 0.078*[# 5]+0.078*[# 13]+0.078*[# 29]+0.059*[# 9]+0.059*[# 17] + +0.059*[# 21]+0.059*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.69934 eV ==== + psi = 0.117*[# 1]+0.059*[# 9]+0.059*[# 17]+0.059*[# 21]+0.059*[# 25] + +0.039*[# 5]+0.039*[# 13]+0.039*[# 29]+0.029*[# 7]+0.029*[# 16] + +0.029*[# 30]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 18] + +0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23]+0.016*[# 24] + +0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.013*[# 6]+0.013*[# 8] + +0.013*[# 14]+0.013*[# 15]+0.013*[# 31]+0.013*[# 32]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4] + |psi|^2 = 0.856 +==== e( 7) = 1.70960 eV ==== + psi = 0.051*[# 5]+0.051*[# 13]+0.051*[# 29]+0.048*[# 7]+0.048*[# 16] + +0.048*[# 30]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.029*[# 1]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.020*[# 2] + +0.020*[# 3]+0.020*[# 4] + |psi|^2 = 1.035 +==== e( 8) = 1.71009 eV ==== + psi = 0.062*[# 1]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.027*[# 2] + +0.027*[# 3]+0.027*[# 4]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12] + +0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23] + +0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.899 +==== e( 9) = 2.10371 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.10436 eV ==== + psi = 0.050*[# 7]+0.050*[# 16]+0.050*[# 30]+0.045*[# 2]+0.045*[# 3] + +0.045*[# 4]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.017*[# 1] + +0.009*[# 9]+0.009*[# 17]+0.009*[# 21]+0.009*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 0.938 +==== e( 11) = 3.36740 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30] + |psi|^2 = 1.043 +==== e( 12) = 3.36742 eV ==== + psi = 0.067*[# 2]+0.067*[# 3]+0.067*[# 4]+0.051*[# 7]+0.051*[# 16] + +0.051*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.001*[# 1] + + |psi|^2 = 0.988 +==== e( 13) = 4.14946 eV ==== + psi = 0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.028*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.988 +==== e( 14) = 4.14988 eV ==== + psi = 0.056*[# 7]+0.056*[# 16]+0.056*[# 30]+0.052*[# 2]+0.052*[# 3] + +0.052*[# 4]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.002*[# 1] + |psi|^2 = 1.156 +==== e( 15) = 4.40345 eV ==== + psi = 0.042*[# 7]+0.042*[# 16]+0.042*[# 30]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.030*[# 31] + +0.030*[# 32]+0.019*[# 2]+0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.728 +==== e( 16) = 4.40456 eV ==== + psi = 0.069*[# 2]+0.069*[# 3]+0.069*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.896 + + k = 0.6666666667 0.8333333333 0.1666666667 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.118 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.136 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.026*[# 7]+0.026*[# 16] + +0.026*[# 30]+0.015*[# 10]+0.015*[# 11]+0.015*[# 12]+0.015*[# 18] + +0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24] + +0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.012*[# 6]+0.012*[# 8] + +0.012*[# 14]+0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4] + |psi|^2 = 0.853 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.020*[# 7]+0.020*[# 16] + +0.020*[# 30]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.743 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.045*[# 2]+0.045*[# 3]+0.045*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 1.070 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.985 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23] + +0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.040*[# 31] + +0.040*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.952 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.030*[# 6]+0.030*[# 7] + +0.030*[# 8]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14] + +0.030*[# 15]+0.030*[# 16]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.030*[# 30]+0.030*[# 31]+0.030*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.807 + + k = 0.8333333333 0.8333333333 0.1666666667 +==== e( 1) = -5.46675 eV ==== + psi = 0.107*[# 5]+0.107*[# 9]+0.107*[# 13]+0.107*[# 17]+0.107*[# 21] + +0.107*[# 25]+0.107*[# 29]+0.107*[# 1]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4]+0.006*[# 6]+0.006*[# 7]+0.006*[# 8]+0.006*[# 10] + +0.006*[# 11]+0.006*[# 12]+0.006*[# 14]+0.006*[# 15]+0.006*[# 16] + +0.006*[# 18]+0.006*[# 19]+0.006*[# 20]+0.006*[# 22]+0.006*[# 23] + +0.006*[# 24]+0.006*[# 26]+0.006*[# 27]+0.006*[# 28]+0.006*[# 30] + +0.006*[# 31]+0.006*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.818 +==== e( 3) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 18]+0.023*[# 19] + +0.023*[# 20]+0.023*[# 22]+0.023*[# 23]+0.023*[# 24]+0.023*[# 26] + +0.023*[# 27]+0.023*[# 28]+0.023*[# 6]+0.023*[# 8]+0.023*[# 14] + +0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30] + |psi|^2 = 1.193 +==== e( 4) = -2.74636 eV ==== + psi = 0.237*[# 1]+0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25] + +0.026*[# 5]+0.026*[# 13]+0.026*[# 29]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30]+0.012*[# 6]+0.012*[# 8]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 14]+0.012*[# 15]+0.012*[# 18]+0.012*[# 19] + +0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26] + +0.012*[# 27]+0.012*[# 28]+0.012*[# 31]+0.012*[# 32]+0.009*[# 2] + +0.009*[# 3]+0.009*[# 4] + |psi|^2 = 0.922 +==== e( 5) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.019*[# 10]+0.019*[# 11]+0.019*[# 12]+0.019*[# 18] + +0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23]+0.019*[# 24] + +0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.019*[# 10]+0.019*[# 11]+0.019*[# 12]+0.019*[# 18] + +0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23]+0.019*[# 24] + +0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.010*[# 7]+0.010*[# 16] + +0.010*[# 30] + |psi|^2 = 0.991 +==== e( 7) = -0.41176 eV ==== + psi = 0.204*[# 1]+0.068*[# 9]+0.068*[# 17]+0.068*[# 21]+0.068*[# 25] + +0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.023*[# 5]+0.023*[# 13] + +0.023*[# 29]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18] + +0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24] + +0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 1.038 +==== e( 8) = 2.48448 eV ==== + psi = 0.048*[# 6]+0.048*[# 8]+0.048*[# 14]+0.048*[# 15]+0.048*[# 31] + +0.048*[# 32]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 18] + +0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24] + +0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.022*[# 7]+0.022*[# 16] + +0.022*[# 30]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.817 +==== e( 9) = 2.48448 eV ==== + psi = 0.056*[# 6]+0.056*[# 8]+0.056*[# 14]+0.056*[# 15]+0.056*[# 31] + +0.056*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.029*[# 7]+0.029*[# 16] + +0.029*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.48501 eV ==== + psi = 0.066*[# 2]+0.066*[# 3]+0.066*[# 4]+0.042*[# 7]+0.042*[# 16] + +0.042*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.009*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.951 +==== e( 11) = 3.58915 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.985 +==== e( 12) = 3.58971 eV ==== + psi = 0.057*[# 2]+0.057*[# 3]+0.057*[# 4]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.029*[# 6]+0.029*[# 8] + +0.029*[# 14]+0.029*[# 15]+0.029*[# 31]+0.029*[# 32] + |psi|^2 = 0.895 +==== e( 13) = 3.58971 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 7]+0.062*[# 16] + +0.062*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 3.76658 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14]+0.041*[# 15] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.041*[# 31] + +0.041*[# 32]+0.028*[# 1]+0.028*[# 5]+0.028*[# 9]+0.028*[# 13] + +0.028*[# 17]+0.028*[# 21]+0.028*[# 25]+0.028*[# 29]+0.022*[# 7] + +0.022*[# 16]+0.022*[# 30] + |psi|^2 = 1.211 +==== e( 15) = 5.71627 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.046*[# 6]+0.045*[# 7] + +0.046*[# 8]+0.046*[# 10]+0.046*[# 11]+0.046*[# 12]+0.046*[# 14] + +0.046*[# 15]+0.045*[# 16]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.045*[# 30]+0.046*[# 31]+0.046*[# 32] + |psi|^2 = 1.092 +==== e( 16) = 5.71627 eV ==== + psi = 0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.030*[# 6]+0.030*[# 7] + +0.030*[# 8]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14] + +0.030*[# 15]+0.030*[# 16]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.030*[# 30]+0.030*[# 31]+0.030*[# 32] + |psi|^2 = 0.711 + + k = 0.0000000000 0.0000000000 0.3333333333 +==== e( 1) = -5.34348 eV ==== + psi = 0.103*[# 5]+0.103*[# 9]+0.103*[# 13]+0.103*[# 17]+0.103*[# 21] + +0.103*[# 25]+0.103*[# 29]+0.103*[# 1]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4]+0.007*[# 6]+0.007*[# 7]+0.007*[# 8]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 14]+0.007*[# 15]+0.007*[# 16] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.007*[# 30] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.91783 eV ==== + psi = 0.082*[# 1]+0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.082*[# 29] + |psi|^2 = 0.658 +==== e( 3) = -1.54469 eV ==== + psi = 0.152*[# 9]+0.152*[# 17]+0.152*[# 21]+0.152*[# 25]+0.046*[# 2] + +0.046*[# 3]+0.046*[# 4]+0.046*[# 6]+0.046*[# 7]+0.046*[# 8] + +0.046*[# 14]+0.046*[# 15]+0.046*[# 16]+0.046*[# 30]+0.046*[# 31] + +0.046*[# 32]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12]+0.014*[# 18] + +0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24] + +0.014*[# 26]+0.014*[# 27]+0.014*[# 28] + |psi|^2 = 1.330 +==== e( 4) = -1.54469 eV ==== + psi = 0.152*[# 9]+0.152*[# 17]+0.152*[# 21]+0.152*[# 25]+0.032*[# 2] + +0.032*[# 3]+0.032*[# 4]+0.032*[# 6]+0.032*[# 7]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 16]+0.032*[# 30]+0.032*[# 31] + +0.032*[# 32] + |psi|^2 = 0.994 +==== e( 5) = -1.54458 eV ==== + psi = 0.202*[# 5]+0.202*[# 13]+0.202*[# 29]+0.032*[# 10]+0.032*[# 11] + +0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22] + +0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + + |psi|^2 = 0.994 +==== e( 6) = -1.54312 eV ==== + psi = 0.304*[# 1]+0.101*[# 5]+0.101*[# 13]+0.101*[# 29]+0.048*[# 10] + +0.048*[# 11]+0.048*[# 12]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28] + |psi|^2 = 1.187 +==== e( 7) = 1.14721 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29] + |psi|^2 = 0.503 +==== e( 8) = 2.47079 eV ==== + psi = 0.065*[# 10]+0.065*[# 11]+0.065*[# 12]+0.065*[# 18]+0.065*[# 19] + +0.065*[# 20]+0.065*[# 22]+0.065*[# 23]+0.065*[# 24]+0.065*[# 26] + +0.065*[# 27]+0.065*[# 28]+0.003*[# 5]+0.003*[# 13]+0.003*[# 29] + + |psi|^2 = 0.789 +==== e( 9) = 2.47096 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 6]+0.049*[# 7] + +0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 16]+0.049*[# 30] + +0.049*[# 31]+0.049*[# 32]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.002*[# 9] + +0.002*[# 17]+0.002*[# 21]+0.002*[# 25] + |psi|^2 = 0.994 +==== e( 10) = 2.47096 eV ==== + psi = 0.082*[# 6]+0.082*[# 8]+0.082*[# 14]+0.082*[# 15]+0.082*[# 31] + +0.082*[# 32]+0.072*[# 7]+0.072*[# 16]+0.072*[# 30]+0.072*[# 2] + +0.072*[# 3]+0.072*[# 4]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.928 +==== e( 11) = 2.47113 eV ==== + psi = 0.082*[# 10]+0.082*[# 11]+0.082*[# 12]+0.082*[# 18]+0.082*[# 19] + +0.082*[# 20]+0.082*[# 22]+0.082*[# 23]+0.082*[# 24]+0.082*[# 26] + +0.082*[# 27]+0.082*[# 28]+0.004*[# 1]+0.002*[# 5]+0.002*[# 13] + +0.002*[# 29] + |psi|^2 = 0.994 +==== e( 12) = 3.72629 eV ==== + psi = 0.068*[# 7]+0.068*[# 16]+0.068*[# 30]+0.068*[# 2]+0.068*[# 3] + +0.068*[# 4]+0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15] + +0.058*[# 31]+0.058*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + |psi|^2 = 1.248 +==== e( 13) = 3.72629 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.993 +==== e( 14) = 4.12437 eV ==== + psi = 0.043*[# 1]+0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17] + +0.043*[# 21]+0.043*[# 25]+0.043*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 6]+0.033*[# 7]+0.033*[# 8]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32] + +0.007*[# 10]+0.007*[# 11]+0.007*[# 12]+0.007*[# 18]+0.007*[# 19] + +0.007*[# 20]+0.007*[# 22]+0.007*[# 23]+0.007*[# 24]+0.007*[# 26] + +0.007*[# 27]+0.007*[# 28] + |psi|^2 = 0.823 +==== e( 15) = 4.96156 eV ==== + psi = 0.068*[# 2]+0.068*[# 3]+0.068*[# 4]+0.067*[# 6]+0.067*[# 7] + +0.067*[# 8]+0.067*[# 10]+0.067*[# 11]+0.067*[# 12]+0.067*[# 14] + +0.067*[# 15]+0.067*[# 16]+0.067*[# 18]+0.067*[# 19]+0.067*[# 20] + +0.067*[# 22]+0.067*[# 23]+0.067*[# 24]+0.067*[# 26]+0.067*[# 27] + +0.067*[# 28]+0.067*[# 30]+0.067*[# 31]+0.067*[# 32] + |psi|^2 = 1.618 +==== e( 16) = 4.96156 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.983 + + k = 0.1666666667 0.0000000000 0.3333333333 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.002*[# 6]+0.002*[# 7]+0.002*[# 8]+0.002*[# 10] + +0.002*[# 11]+0.002*[# 12]+0.002*[# 14]+0.002*[# 15]+0.002*[# 16] + +0.002*[# 18]+0.002*[# 19]+0.002*[# 20]+0.002*[# 22]+0.002*[# 23] + +0.002*[# 24]+0.002*[# 26]+0.002*[# 27]+0.002*[# 28]+0.002*[# 30] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.713 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 7]+0.027*[# 8]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 16] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 30] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 1.296 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 0.986 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 7]+0.021*[# 8]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 14]+0.021*[# 15]+0.021*[# 16] + +0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23] + +0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.021*[# 30] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.056 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.596 +==== e( 8) = 1.85450 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.039*[# 6]+0.039*[# 7] + +0.039*[# 8]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 14] + +0.039*[# 15]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.039*[# 30]+0.039*[# 31]+0.039*[# 32] + |psi|^2 = 0.925 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.030*[# 6]+0.030*[# 14]+0.030*[# 32]+0.030*[# 2]+0.030*[# 3] + +0.030*[# 4]+0.030*[# 7]+0.030*[# 15]+0.030*[# 8]+0.030*[# 10] + +0.030*[# 11]+0.030*[# 12]+0.030*[# 28]+0.030*[# 31]+0.030*[# 16] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 30] + |psi|^2 = 0.722 +==== e( 11) = 3.29155 eV ==== + psi = 0.055*[# 6]+0.055*[# 7]+0.055*[# 8]+0.055*[# 14]+0.055*[# 15] + +0.055*[# 16]+0.055*[# 31]+0.055*[# 32]+0.055*[# 10]+0.055*[# 12] + +0.055*[# 11]+0.055*[# 18]+0.055*[# 19]+0.055*[# 20]+0.055*[# 30] + +0.055*[# 22]+0.055*[# 23]+0.055*[# 24]+0.055*[# 26]+0.055*[# 27] + +0.055*[# 28]+0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.349 +==== e( 12) = 3.36033 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 18] + +0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24] + +0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.797 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.044*[# 7]+0.043*[# 6] + +0.043*[# 8]+0.044*[# 10]+0.044*[# 16]+0.044*[# 11]+0.044*[# 12] + +0.043*[# 14]+0.043*[# 15]+0.044*[# 18]+0.044*[# 19]+0.044*[# 20] + +0.044*[# 30]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24]+0.044*[# 26] + +0.044*[# 27]+0.044*[# 28]+0.043*[# 31]+0.043*[# 32] + |psi|^2 = 1.048 +==== e( 15) = 4.50839 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.009 +==== e( 16) = 5.45761 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.047*[# 6]+0.047*[# 7] + +0.047*[# 8]+0.047*[# 10]+0.047*[# 11]+0.047*[# 12]+0.047*[# 14] + +0.047*[# 15]+0.047*[# 16]+0.047*[# 18]+0.047*[# 19]+0.047*[# 20] + +0.047*[# 22]+0.047*[# 23]+0.047*[# 24]+0.047*[# 26]+0.047*[# 27] + +0.047*[# 28]+0.047*[# 30]+0.047*[# 31]+0.047*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.168 + + k = 0.3333333333 0.0000000000 0.3333333333 +==== e( 1) = -4.87592 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.52951 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.959 +==== e( 3) = -3.52873 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.54529 eV ==== + psi = 0.085*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.085*[# 5]+0.085*[# 13]+0.085*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11] + +0.016*[# 12]+0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19] + +0.016*[# 20]+0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26] + +0.016*[# 27]+0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.055 +==== e( 5) = -0.62188 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.994 +==== e( 6) = 0.50951 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.061*[# 9]+0.061*[# 17] + +0.061*[# 21]+0.061*[# 25]+0.026*[# 6]+0.026*[# 8]+0.026*[# 14] + +0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.018*[# 10]+0.018*[# 11] + +0.018*[# 12]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22] + +0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28] + +0.015*[# 2]+0.015*[# 3]+0.015*[# 4]+0.005*[# 7]+0.005*[# 16] + +0.005*[# 30] + |psi|^2 = 0.910 +==== e( 7) = 0.50974 eV ==== + psi = 0.122*[# 1]+0.061*[# 9]+0.061*[# 17]+0.061*[# 21]+0.061*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.029*[# 2]+0.029*[# 3] + +0.029*[# 4]+0.029*[# 7]+0.029*[# 16]+0.029*[# 30]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.992 +==== e( 8) = 1.69051 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.035*[# 6]+0.035*[# 8] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14]+0.035*[# 15] + +0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23] + +0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 31] + +0.035*[# 32]+0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.002*[# 1] + +0.002*[# 5]+0.002*[# 9]+0.002*[# 13]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.002*[# 29] + |psi|^2 = 0.857 +==== e( 9) = 2.43371 eV ==== + psi = 0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17]+0.043*[# 21] + +0.043*[# 25]+0.043*[# 29]+0.043*[# 1]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 0.987 +==== e( 10) = 2.54749 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.049*[# 2]+0.049*[# 3] + +0.049*[# 4]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.015*[# 1] + +0.008*[# 9]+0.008*[# 17]+0.008*[# 21]+0.008*[# 25]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29] + |psi|^2 = 0.979 +==== e( 11) = 2.54759 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29]+0.008*[# 9]+0.008*[# 17]+0.008*[# 21] + +0.008*[# 25] + |psi|^2 = 0.992 +==== e( 12) = 3.71718 eV ==== + psi = 0.049*[# 7]+0.049*[# 16]+0.049*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23] + +0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.040*[# 31] + +0.040*[# 32]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.027 +==== e( 13) = 3.84161 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 14]+0.050*[# 15]+0.050*[# 31]+0.050*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.002*[# 5]+0.002*[# 13]+0.002*[# 29]+0.001*[# 9] + +0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 3.84259 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.049*[# 7]+0.049*[# 16] + +0.049*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 15) = 4.03675 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.878 +==== e( 16) = 5.60339 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.036*[# 6]+0.036*[# 8] + +0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 14]+0.036*[# 15] + +0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23] + +0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.036*[# 31] + +0.036*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.873 + + k = 0.5000000000 0.0000000000 0.3333333333 +==== e( 1) = -4.30426 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.30321 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.017*[# 10] + +0.017*[# 11]+0.017*[# 12]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20] + +0.017*[# 22]+0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27] + +0.017*[# 28]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.001*[# 7] + +0.001*[# 16]+0.001*[# 30] + |psi|^2 = 1.117 +==== e( 3) = -3.08338 eV ==== + psi = 0.113*[# 5]+0.113*[# 13]+0.113*[# 29]+0.084*[# 9]+0.084*[# 17] + +0.084*[# 21]+0.084*[# 25]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.889 +==== e( 4) = -3.08238 eV ==== + psi = 0.169*[# 1]+0.084*[# 9]+0.084*[# 17]+0.084*[# 21]+0.084*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.022*[# 7]+0.022*[# 16] + +0.022*[# 30]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28] + |psi|^2 = 1.012 +==== e( 5) = -0.06735 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.060*[# 9]+0.060*[# 17] + +0.060*[# 21]+0.060*[# 25]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + +0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19] + +0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26] + +0.021*[# 27]+0.021*[# 28]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 16]+0.018*[# 30]+0.018*[# 31] + +0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.06705 eV ==== + psi = 0.121*[# 1]+0.060*[# 9]+0.060*[# 17]+0.060*[# 21]+0.060*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.024*[# 7]+0.024*[# 16] + +0.024*[# 30]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.920 +==== e( 7) = 1.46284 eV ==== + psi = 0.102*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30]+0.012*[# 2] + +0.012*[# 3]+0.012*[# 4] + |psi|^2 = 1.009 +==== e( 8) = 1.46285 eV ==== + psi = 0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.038*[# 2]+0.038*[# 3]+0.038*[# 4] + +0.025*[# 7]+0.025*[# 16]+0.025*[# 30]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22] + +0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + +0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15]+0.012*[# 31] + +0.012*[# 32] + |psi|^2 = 0.936 +==== e( 9) = 1.95717 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 1.95751 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.047*[# 7]+0.047*[# 16] + +0.047*[# 30]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 1.057 +==== e( 11) = 3.02286 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.020*[# 1]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.007*[# 5]+0.007*[# 13]+0.007*[# 29] + |psi|^2 = 0.956 +==== e( 12) = 3.02323 eV ==== + psi = 0.078*[# 2]+0.078*[# 3]+0.078*[# 4]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.033*[# 6]+0.033*[# 8]+0.033*[# 14]+0.033*[# 15]+0.033*[# 31] + +0.033*[# 32]+0.013*[# 5]+0.013*[# 13]+0.013*[# 29]+0.013*[# 7] + +0.013*[# 16]+0.013*[# 30]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25] + |psi|^2 = 1.020 +==== e( 13) = 4.06622 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 4.06644 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.979 +==== e( 15) = 4.88257 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.034*[# 7]+0.034*[# 16]+0.034*[# 30]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.966 +==== e( 16) = 4.88277 eV ==== + psi = 0.056*[# 6]+0.056*[# 8]+0.056*[# 14]+0.056*[# 15]+0.056*[# 31] + +0.056*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.004*[# 1]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.001*[# 5]+0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.955 + + k = 0.6666666667 0.0000000000 0.3333333333 +==== e( 1) = -4.87592 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.52951 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.959 +==== e( 3) = -3.52873 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.54529 eV ==== + psi = 0.085*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.085*[# 5]+0.085*[# 13]+0.085*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11] + +0.016*[# 12]+0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19] + +0.016*[# 20]+0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26] + +0.016*[# 27]+0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.055 +==== e( 5) = -0.62188 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.994 +==== e( 6) = 0.50951 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.061*[# 9]+0.061*[# 17] + +0.061*[# 21]+0.061*[# 25]+0.026*[# 6]+0.026*[# 8]+0.026*[# 14] + +0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.018*[# 10]+0.018*[# 11] + +0.018*[# 12]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22] + +0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28] + +0.015*[# 2]+0.015*[# 3]+0.015*[# 4]+0.005*[# 7]+0.005*[# 16] + +0.005*[# 30] + |psi|^2 = 0.910 +==== e( 7) = 0.50974 eV ==== + psi = 0.122*[# 1]+0.061*[# 9]+0.061*[# 17]+0.061*[# 21]+0.061*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.029*[# 2]+0.029*[# 3] + +0.029*[# 4]+0.029*[# 7]+0.029*[# 16]+0.029*[# 30]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.992 +==== e( 8) = 1.69051 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.035*[# 6]+0.035*[# 8] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14]+0.035*[# 15] + +0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23] + +0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 31] + +0.035*[# 32]+0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.002*[# 1] + +0.002*[# 5]+0.002*[# 9]+0.002*[# 13]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.002*[# 29] + |psi|^2 = 0.857 +==== e( 9) = 2.43371 eV ==== + psi = 0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17]+0.043*[# 21] + +0.043*[# 25]+0.043*[# 29]+0.043*[# 1]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 0.987 +==== e( 10) = 2.54749 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.049*[# 2]+0.049*[# 3] + +0.049*[# 4]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.015*[# 1] + +0.008*[# 9]+0.008*[# 17]+0.008*[# 21]+0.008*[# 25]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29] + |psi|^2 = 0.979 +==== e( 11) = 2.54759 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29]+0.008*[# 9]+0.008*[# 17]+0.008*[# 21] + +0.008*[# 25] + |psi|^2 = 0.992 +==== e( 12) = 3.71718 eV ==== + psi = 0.049*[# 7]+0.049*[# 16]+0.049*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23] + +0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.040*[# 31] + +0.040*[# 32]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.027 +==== e( 13) = 3.84161 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 14]+0.050*[# 15]+0.050*[# 31]+0.050*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.002*[# 5]+0.002*[# 13]+0.002*[# 29]+0.001*[# 9] + +0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 3.84259 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.049*[# 7]+0.049*[# 16] + +0.049*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 15) = 4.03675 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.878 +==== e( 16) = 5.60339 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.036*[# 6]+0.036*[# 8] + +0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 14]+0.036*[# 15] + +0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23] + +0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.036*[# 31] + +0.036*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.873 + + k = 0.8333333333 0.0000000000 0.3333333333 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.002*[# 6]+0.002*[# 7]+0.002*[# 8]+0.002*[# 10] + +0.002*[# 11]+0.002*[# 12]+0.002*[# 14]+0.002*[# 15]+0.002*[# 16] + +0.002*[# 18]+0.002*[# 19]+0.002*[# 20]+0.002*[# 22]+0.002*[# 23] + +0.002*[# 24]+0.002*[# 26]+0.002*[# 27]+0.002*[# 28]+0.002*[# 30] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.713 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 7]+0.027*[# 8]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 16] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 30] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 1.296 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 0.986 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 7]+0.021*[# 8]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 14]+0.021*[# 15]+0.021*[# 16] + +0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23] + +0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.021*[# 30] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.056 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.596 +==== e( 8) = 1.85450 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.039*[# 6]+0.039*[# 7] + +0.039*[# 8]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 14] + +0.039*[# 15]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.039*[# 30]+0.039*[# 31]+0.039*[# 32] + |psi|^2 = 0.925 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.030*[# 6]+0.030*[# 14]+0.030*[# 32]+0.030*[# 2]+0.030*[# 3] + +0.030*[# 4]+0.030*[# 7]+0.030*[# 15]+0.030*[# 8]+0.030*[# 10] + +0.030*[# 11]+0.030*[# 12]+0.030*[# 28]+0.030*[# 31]+0.030*[# 16] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 30] + |psi|^2 = 0.722 +==== e( 11) = 3.29155 eV ==== + psi = 0.055*[# 6]+0.055*[# 7]+0.055*[# 8]+0.055*[# 14]+0.055*[# 15] + +0.055*[# 16]+0.055*[# 31]+0.055*[# 32]+0.055*[# 10]+0.055*[# 12] + +0.055*[# 11]+0.055*[# 18]+0.055*[# 19]+0.055*[# 20]+0.055*[# 30] + +0.055*[# 22]+0.055*[# 23]+0.055*[# 24]+0.055*[# 26]+0.055*[# 27] + +0.055*[# 28]+0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.349 +==== e( 12) = 3.36033 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 18] + +0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24] + +0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.797 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.044*[# 7]+0.043*[# 6] + +0.043*[# 8]+0.044*[# 10]+0.044*[# 16]+0.044*[# 11]+0.044*[# 12] + +0.043*[# 14]+0.043*[# 15]+0.044*[# 18]+0.044*[# 19]+0.044*[# 20] + +0.044*[# 30]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24]+0.044*[# 26] + +0.044*[# 27]+0.044*[# 28]+0.043*[# 31]+0.043*[# 32] + |psi|^2 = 1.048 +==== e( 15) = 4.50839 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.009 +==== e( 16) = 5.45761 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.047*[# 6]+0.047*[# 7] + +0.047*[# 8]+0.047*[# 10]+0.047*[# 11]+0.047*[# 12]+0.047*[# 14] + +0.047*[# 15]+0.047*[# 16]+0.047*[# 18]+0.047*[# 19]+0.047*[# 20] + +0.047*[# 22]+0.047*[# 23]+0.047*[# 24]+0.047*[# 26]+0.047*[# 27] + +0.047*[# 28]+0.047*[# 30]+0.047*[# 31]+0.047*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.168 + + k = 0.0000000000 0.1666666667 0.3333333333 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1] + |psi|^2 = 0.679 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 7]+0.027*[# 8]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 16] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 30] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 1.296 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.980 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 6]+0.032*[# 7]+0.032*[# 8]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15]+0.032*[# 16] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 30] + +0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.332 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.596 +==== e( 8) = 1.85450 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.032*[# 6]+0.032*[# 7] + +0.032*[# 8]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 14] + +0.032*[# 15]+0.032*[# 16]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28]+0.032*[# 30]+0.032*[# 31]+0.032*[# 32] + |psi|^2 = 0.767 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.042*[# 2]+0.042*[# 3]+0.042*[# 4]+0.042*[# 6]+0.042*[# 7] + +0.042*[# 8]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 14] + +0.042*[# 15]+0.042*[# 16]+0.042*[# 18]+0.042*[# 19]+0.042*[# 20] + +0.042*[# 22]+0.042*[# 23]+0.042*[# 24]+0.042*[# 26]+0.042*[# 27] + +0.042*[# 28]+0.042*[# 30]+0.042*[# 31]+0.042*[# 32] + |psi|^2 = 1.013 +==== e( 11) = 3.29155 eV ==== + psi = 0.055*[# 6]+0.055*[# 7]+0.055*[# 8]+0.055*[# 14]+0.055*[# 15] + +0.055*[# 16]+0.055*[# 31]+0.055*[# 32]+0.055*[# 10]+0.055*[# 12] + +0.055*[# 11]+0.055*[# 18]+0.055*[# 19]+0.055*[# 20]+0.055*[# 30] + +0.055*[# 22]+0.055*[# 23]+0.055*[# 24]+0.055*[# 26]+0.055*[# 27] + +0.055*[# 28]+0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.349 +==== e( 12) = 3.36033 eV ==== + psi = 0.036*[# 2]+0.036*[# 3]+0.036*[# 4]+0.036*[# 7]+0.036*[# 16] + +0.036*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.036*[# 6]+0.036*[# 8] + +0.036*[# 14]+0.036*[# 15]+0.036*[# 31]+0.036*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.879 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.043*[# 7]+0.043*[# 16] + +0.043*[# 30]+0.043*[# 6]+0.043*[# 8]+0.043*[# 10]+0.043*[# 11] + +0.043*[# 12]+0.043*[# 14]+0.043*[# 15]+0.043*[# 18]+0.043*[# 19] + +0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24]+0.043*[# 26] + +0.043*[# 27]+0.043*[# 28]+0.043*[# 31]+0.043*[# 32] + |psi|^2 = 1.026 +==== e( 15) = 4.50839 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.009 +==== e( 16) = 5.45761 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14]+0.041*[# 15] + +0.041*[# 7]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 32] + +0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 30]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.015 + + k = 0.1666666667 0.1666666667 0.3333333333 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.730 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.025*[# 31]+0.025*[# 32]+0.025*[# 7]+0.025*[# 16] + +0.025*[# 30] + |psi|^2 = 1.271 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 10]+0.014*[# 11] + +0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 18]+0.014*[# 19] + +0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26] + +0.014*[# 27]+0.014*[# 28]+0.014*[# 31]+0.014*[# 32]+0.013*[# 2] + +0.013*[# 3]+0.013*[# 4] + |psi|^2 = 0.990 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.041*[# 7]+0.041*[# 16] + +0.041*[# 30]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 18] + +0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24] + +0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.133 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.742 +==== e( 8) = 2.16363 eV ==== + psi = 0.043*[# 7]+0.043*[# 16]+0.043*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.899 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 7]+0.038*[# 16] + +0.038*[# 30]+0.036*[# 1]+0.036*[# 5]+0.036*[# 9]+0.036*[# 13] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.036*[# 29]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15] + +0.025*[# 31]+0.025*[# 32] + |psi|^2 = 1.049 +==== e( 11) = 3.13966 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.037*[# 6]+0.037*[# 7] + +0.037*[# 8]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 16]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.037*[# 30]+0.037*[# 31]+0.037*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.963 +==== e( 12) = 3.51483 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.756 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.054*[# 6]+0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31] + +0.054*[# 32]+0.052*[# 10]+0.052*[# 11]+0.052*[# 12]+0.052*[# 18] + +0.052*[# 19]+0.052*[# 20]+0.052*[# 22]+0.052*[# 23]+0.052*[# 24] + +0.052*[# 26]+0.052*[# 27]+0.052*[# 28]+0.050*[# 2]+0.050*[# 3] + +0.050*[# 4]+0.050*[# 7]+0.050*[# 16]+0.050*[# 30] + |psi|^2 = 1.256 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.983 +==== e( 16) = 5.23066 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 6]+0.035*[# 7] + +0.035*[# 8]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 16]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.035*[# 30]+0.035*[# 31]+0.035*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.927 + + k = 0.3333333333 0.1666666667 0.3333333333 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.961 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.015*[# 6]+0.015*[# 8]+0.015*[# 10]+0.015*[# 11] + +0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 18]+0.015*[# 19] + +0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26] + +0.015*[# 27]+0.015*[# 28]+0.015*[# 31]+0.015*[# 32]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.072 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.032*[# 6]+0.032*[# 8]+0.032*[# 14] + +0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.023*[# 10]+0.023*[# 11] + +0.023*[# 12]+0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22] + +0.023*[# 23]+0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.962 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 18]+0.027*[# 19] + +0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26] + +0.027*[# 27]+0.027*[# 28]+0.027*[# 31]+0.027*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 0.953 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.018*[# 7] + +0.018*[# 16]+0.018*[# 30]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.978 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + |psi|^2 = 0.907 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.035*[# 6]+0.035*[# 8] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14]+0.035*[# 15] + +0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23] + +0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 31] + +0.035*[# 32]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30] + |psi|^2 = 0.835 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 + + k = 0.5000000000 0.1666666667 0.3333333333 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 1.108 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.911 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.023*[# 7]+0.023*[# 16] + +0.023*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 1.025 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.025*[# 2] + +0.025*[# 3]+0.025*[# 4]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.013*[# 7] + +0.013*[# 16]+0.013*[# 30] + |psi|^2 = 0.956 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.037*[# 7]+0.037*[# 16]+0.037*[# 30] + +0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.019*[# 1]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.987 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4]+0.013*[# 7] + +0.013*[# 16]+0.013*[# 30] + |psi|^2 = 0.952 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.031*[# 6]+0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31] + +0.031*[# 32]+0.029*[# 1]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.964 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 1.047 +==== e( 12) = 3.70168 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.046*[# 6]+0.046*[# 8] + +0.046*[# 14]+0.046*[# 15]+0.046*[# 31]+0.046*[# 32]+0.038*[# 10] + +0.038*[# 11]+0.038*[# 12]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.028*[# 1]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.010*[# 5]+0.010*[# 13]+0.010*[# 29]+0.007*[# 7] + +0.007*[# 16]+0.007*[# 30] + |psi|^2 = 1.018 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.040*[# 2]+0.040*[# 3] + +0.040*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.002*[# 1] + + |psi|^2 = 1.058 +==== e( 15) = 4.84656 eV ==== + psi = 0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.879 +==== e( 16) = 4.84692 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.041*[# 7]+0.041*[# 16]+0.041*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.947 + + k = 0.6666666667 0.1666666667 0.3333333333 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.961 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.015*[# 6]+0.015*[# 8]+0.015*[# 10]+0.015*[# 11] + +0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 18]+0.015*[# 19] + +0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26] + +0.015*[# 27]+0.015*[# 28]+0.015*[# 31]+0.015*[# 32]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.072 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.032*[# 6]+0.032*[# 8]+0.032*[# 14] + +0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.023*[# 10]+0.023*[# 11] + +0.023*[# 12]+0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22] + +0.023*[# 23]+0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.962 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 18]+0.027*[# 19] + +0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26] + +0.027*[# 27]+0.027*[# 28]+0.027*[# 31]+0.027*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 0.953 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.018*[# 7] + +0.018*[# 16]+0.018*[# 30]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.978 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + |psi|^2 = 0.907 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.035*[# 6]+0.035*[# 8] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14]+0.035*[# 15] + +0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23] + +0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 31] + +0.035*[# 32]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30] + |psi|^2 = 0.835 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 + + k = 0.8333333333 0.1666666667 0.3333333333 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.730 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.025*[# 31]+0.025*[# 32]+0.025*[# 7]+0.025*[# 16] + +0.025*[# 30] + |psi|^2 = 1.271 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 10]+0.014*[# 11] + +0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 18]+0.014*[# 19] + +0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26] + +0.014*[# 27]+0.014*[# 28]+0.014*[# 31]+0.014*[# 32]+0.013*[# 2] + +0.013*[# 3]+0.013*[# 4] + |psi|^2 = 0.990 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.041*[# 7]+0.041*[# 16] + +0.041*[# 30]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 18] + +0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24] + +0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.133 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.742 +==== e( 8) = 2.16363 eV ==== + psi = 0.043*[# 7]+0.043*[# 16]+0.043*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.899 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 7]+0.038*[# 16] + +0.038*[# 30]+0.036*[# 1]+0.036*[# 5]+0.036*[# 9]+0.036*[# 13] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.036*[# 29]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15] + +0.025*[# 31]+0.025*[# 32] + |psi|^2 = 1.049 +==== e( 11) = 3.13966 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.037*[# 6]+0.037*[# 7] + +0.037*[# 8]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 16]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.037*[# 30]+0.037*[# 31]+0.037*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.963 +==== e( 12) = 3.51483 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.756 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.054*[# 6]+0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31] + +0.054*[# 32]+0.052*[# 10]+0.052*[# 11]+0.052*[# 12]+0.052*[# 18] + +0.052*[# 19]+0.052*[# 20]+0.052*[# 22]+0.052*[# 23]+0.052*[# 24] + +0.052*[# 26]+0.052*[# 27]+0.052*[# 28]+0.050*[# 2]+0.050*[# 3] + +0.050*[# 4]+0.050*[# 7]+0.050*[# 16]+0.050*[# 30] + |psi|^2 = 1.256 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.983 +==== e( 16) = 5.23066 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 6]+0.035*[# 7] + +0.035*[# 8]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 16]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.035*[# 30]+0.035*[# 31]+0.035*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.927 + + k = 0.0000000000 0.3333333333 0.3333333333 +==== e( 1) = -4.87592 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.52951 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15]+0.009*[# 31] + +0.009*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.002*[# 7]+0.002*[# 16] + +0.002*[# 30] + |psi|^2 = 0.848 +==== e( 3) = -3.52873 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.54529 eV ==== + psi = 0.085*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.085*[# 5]+0.085*[# 13]+0.085*[# 29]+0.011*[# 7]+0.011*[# 16] + +0.011*[# 30]+0.010*[# 6]+0.010*[# 8]+0.010*[# 10]+0.010*[# 11] + +0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.010*[# 31]+0.010*[# 32]+0.009*[# 2] + +0.009*[# 3]+0.009*[# 4] + |psi|^2 = 0.929 +==== e( 5) = -0.62188 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.994 +==== e( 6) = 0.50951 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.061*[# 9]+0.061*[# 17] + +0.061*[# 21]+0.061*[# 25]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.016*[# 7]+0.016*[# 16] + +0.016*[# 30] + |psi|^2 = 1.178 +==== e( 7) = 0.50974 eV ==== + psi = 0.122*[# 1]+0.061*[# 9]+0.061*[# 17]+0.061*[# 21]+0.061*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.029*[# 2]+0.029*[# 3] + +0.029*[# 4]+0.029*[# 7]+0.029*[# 16]+0.029*[# 30]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.992 +==== e( 8) = 1.69051 eV ==== + psi = 0.045*[# 7]+0.045*[# 16]+0.045*[# 30]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.002*[# 1] + +0.002*[# 5]+0.002*[# 9]+0.002*[# 13]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.002*[# 29] + |psi|^2 = 0.892 +==== e( 9) = 2.43371 eV ==== + psi = 0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17]+0.043*[# 21] + +0.043*[# 25]+0.043*[# 29]+0.043*[# 1]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 0.987 +==== e( 10) = 2.54749 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.049*[# 2]+0.049*[# 3] + +0.049*[# 4]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.015*[# 1] + +0.008*[# 9]+0.008*[# 17]+0.008*[# 21]+0.008*[# 25]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29] + |psi|^2 = 0.981 +==== e( 11) = 2.54759 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29]+0.008*[# 9]+0.008*[# 17]+0.008*[# 21] + +0.008*[# 25] + |psi|^2 = 0.992 +==== e( 12) = 3.71718 eV ==== + psi = 0.070*[# 2]+0.070*[# 3]+0.070*[# 4]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 14]+0.050*[# 15] + +0.050*[# 18]+0.050*[# 19]+0.050*[# 20]+0.050*[# 22]+0.050*[# 23] + +0.050*[# 24]+0.050*[# 26]+0.050*[# 27]+0.050*[# 28]+0.050*[# 31] + +0.050*[# 32]+0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.277 +==== e( 13) = 3.84161 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 14]+0.050*[# 15]+0.050*[# 31]+0.050*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.002*[# 5]+0.002*[# 13]+0.002*[# 29]+0.001*[# 9] + +0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 3.84259 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.036*[# 7]+0.036*[# 16] + +0.036*[# 30]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 18] + +0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23]+0.034*[# 24] + +0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.822 +==== e( 15) = 4.03675 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.878 +==== e( 16) = 5.60339 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.029*[# 6]+0.029*[# 8] + +0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14]+0.029*[# 15] + +0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23] + +0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.029*[# 31] + +0.029*[# 32]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30] + |psi|^2 = 0.705 + + k = 0.1666666667 0.3333333333 0.3333333333 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15]+0.010*[# 31] + +0.010*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.883 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30]+0.011*[# 6]+0.011*[# 8]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 18]+0.011*[# 19] + +0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26] + +0.011*[# 27]+0.011*[# 28]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2] + +0.009*[# 3]+0.009*[# 4] + |psi|^2 = 0.963 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.013*[# 7]+0.013*[# 16] + +0.013*[# 30] + |psi|^2 = 1.093 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.019*[# 2] + +0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.991 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.031*[# 2]+0.031*[# 3] + +0.031*[# 4]+0.025*[# 7]+0.025*[# 16]+0.025*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 1.160 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.055*[# 7]+0.055*[# 16]+0.055*[# 30]+0.055*[# 6]+0.055*[# 8] + +0.055*[# 14]+0.055*[# 15]+0.055*[# 31]+0.055*[# 32]+0.042*[# 10] + +0.042*[# 11]+0.042*[# 12]+0.042*[# 18]+0.042*[# 19]+0.042*[# 20] + +0.042*[# 22]+0.042*[# 23]+0.042*[# 24]+0.042*[# 26]+0.042*[# 27] + +0.042*[# 28]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4] + |psi|^2 = 1.016 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.034*[# 6]+0.034*[# 8] + +0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.804 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.020*[# 6]+0.020*[# 7] + +0.020*[# 8]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 14] + +0.020*[# 15]+0.020*[# 16]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.020*[# 30]+0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.492 + + k = 0.3333333333 0.3333333333 0.3333333333 +==== e( 1) = -4.44567 eV ==== + psi = 0.093*[# 5]+0.093*[# 9]+0.093*[# 13]+0.093*[# 17]+0.093*[# 21] + +0.093*[# 25]+0.093*[# 29]+0.092*[# 1]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4]+0.011*[# 6]+0.011*[# 7]+0.011*[# 8]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 16] + +0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23] + +0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.011*[# 30] + +0.011*[# 31]+0.011*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14] + +0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.974 +==== e( 3) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4] + +0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15]+0.014*[# 31] + +0.014*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18] + +0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24] + +0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.005*[# 7]+0.005*[# 16] + +0.005*[# 30] + |psi|^2 = 1.025 +==== e( 4) = -3.32159 eV ==== + psi = 0.272*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.030*[# 5]+0.030*[# 13]+0.030*[# 29]+0.018*[# 7]+0.018*[# 16] + +0.018*[# 30]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 1.018 +==== e( 5) = -0.47745 eV ==== + psi = 0.124*[# 1]+0.081*[# 7]+0.081*[# 16]+0.081*[# 30]+0.041*[# 9] + +0.041*[# 17]+0.041*[# 21]+0.041*[# 25]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.014*[# 5]+0.014*[# 13]+0.014*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.990 +==== e( 6) = -0.47735 eV ==== + psi = 0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.041*[# 9]+0.041*[# 17] + +0.041*[# 21]+0.041*[# 25]+0.038*[# 6]+0.038*[# 8]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 31]+0.038*[# 32]+0.030*[# 2]+0.030*[# 3] + +0.030*[# 4]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.990 +==== e( 7) = -0.47735 eV ==== + psi = 0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.041*[# 9]+0.041*[# 17] + +0.041*[# 21]+0.041*[# 25]+0.039*[# 6]+0.039*[# 8]+0.039*[# 14] + +0.039*[# 15]+0.039*[# 31]+0.039*[# 32]+0.031*[# 2]+0.031*[# 3] + +0.031*[# 4]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + |psi|^2 = 0.990 +==== e( 8) = 0.79675 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.036*[# 2]+0.036*[# 3] + +0.036*[# 4]+0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.028*[# 10] + +0.028*[# 11]+0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15] + +0.023*[# 31]+0.023*[# 32] + |psi|^2 = 0.982 +==== e( 9) = 3.35691 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4] + |psi|^2 = 0.991 +==== e( 10) = 3.35691 eV ==== + psi = 0.045*[# 6]+0.045*[# 8]+0.045*[# 14]+0.045*[# 15]+0.045*[# 31] + +0.045*[# 32]+0.036*[# 7]+0.036*[# 16]+0.036*[# 30]+0.034*[# 10] + +0.034*[# 11]+0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 0.944 +==== e( 11) = 3.35799 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.052*[# 1]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.028*[# 6]+0.028*[# 8]+0.028*[# 14]+0.028*[# 15] + +0.028*[# 31]+0.028*[# 32]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30] + +0.017*[# 9]+0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 0.984 +==== e( 12) = 4.37538 eV ==== + psi = 0.068*[# 6]+0.068*[# 8]+0.068*[# 14]+0.068*[# 15]+0.068*[# 31] + +0.068*[# 32]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.024*[# 7]+0.024*[# 16] + +0.024*[# 30]+0.005*[# 2]+0.005*[# 3]+0.005*[# 4] + |psi|^2 = 0.998 +==== e( 13) = 4.37596 eV ==== + psi = 0.062*[# 7]+0.062*[# 16]+0.062*[# 30]+0.062*[# 2]+0.062*[# 3] + +0.062*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.990 +==== e( 14) = 4.37596 eV ==== + psi = 0.080*[# 2]+0.080*[# 3]+0.080*[# 4]+0.059*[# 7]+0.059*[# 16] + +0.059*[# 30]+0.047*[# 10]+0.047*[# 11]+0.047*[# 12]+0.047*[# 18] + +0.047*[# 19]+0.047*[# 20]+0.047*[# 22]+0.047*[# 23]+0.047*[# 24] + +0.047*[# 26]+0.047*[# 27]+0.047*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32] + |psi|^2 = 1.132 +==== e( 15) = 5.16112 eV ==== + psi = 0.045*[# 6]+0.045*[# 8]+0.045*[# 14]+0.045*[# 15]+0.045*[# 31] + +0.045*[# 32]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.042*[# 2]+0.042*[# 3] + +0.042*[# 4]+0.042*[# 7]+0.042*[# 16]+0.042*[# 30] + |psi|^2 = 1.041 +==== e( 16) = 5.16112 eV ==== + psi = 0.036*[# 2]+0.036*[# 3]+0.036*[# 4]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14]+0.033*[# 15] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.033*[# 31] + +0.033*[# 32]+0.029*[# 7]+0.029*[# 16]+0.029*[# 30] + |psi|^2 = 0.790 + + k = 0.5000000000 0.3333333333 0.3333333333 +==== e( 1) = -3.94104 eV ==== + psi = 0.122*[# 5]+0.122*[# 13]+0.122*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.94002 eV ==== + psi = 0.182*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.061*[# 5]+0.061*[# 13]+0.061*[# 29]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.015*[# 2] + +0.015*[# 3]+0.015*[# 4]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.004*[# 7] + +0.004*[# 16]+0.004*[# 30] + |psi|^2 = 1.079 +==== e( 3) = -3.23789 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.094*[# 9]+0.094*[# 17] + +0.094*[# 21]+0.094*[# 25]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14] + +0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18] + +0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24] + +0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.962 +==== e( 4) = -3.23693 eV ==== + psi = 0.189*[# 1]+0.094*[# 9]+0.094*[# 17]+0.094*[# 21]+0.094*[# 25] + +0.063*[# 5]+0.063*[# 13]+0.063*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 14]+0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.008*[# 2] + +0.008*[# 3]+0.008*[# 4] + |psi|^2 = 1.047 +==== e( 5) = -0.73636 eV ==== + psi = 0.073*[# 1]+0.058*[# 7]+0.058*[# 16]+0.058*[# 30]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.024*[# 5]+0.024*[# 13]+0.024*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.018*[# 2] + +0.018*[# 3]+0.018*[# 4] + |psi|^2 = 0.989 +==== e( 6) = -0.73621 eV ==== + psi = 0.048*[# 5]+0.048*[# 13]+0.048*[# 29]+0.038*[# 2]+0.038*[# 3] + +0.038*[# 4]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 31]+0.037*[# 32]+0.036*[# 9]+0.036*[# 17]+0.036*[# 21] + +0.036*[# 25]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + |psi|^2 = 0.963 +==== e( 7) = 0.03076 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.039*[# 9]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.038*[# 2]+0.038*[# 3]+0.038*[# 4] + +0.036*[# 7]+0.036*[# 16]+0.036*[# 30]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.016*[# 1] + |psi|^2 = 0.996 +==== e( 8) = 0.03135 eV ==== + psi = 0.062*[# 1]+0.039*[# 9]+0.039*[# 17]+0.039*[# 21]+0.039*[# 25] + +0.036*[# 6]+0.036*[# 8]+0.036*[# 14]+0.036*[# 15]+0.036*[# 31] + +0.036*[# 32]+0.031*[# 5]+0.031*[# 13]+0.031*[# 29]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20] + +0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27] + +0.027*[# 28]+0.019*[# 2]+0.019*[# 3]+0.019*[# 4]+0.019*[# 7] + +0.019*[# 16]+0.019*[# 30] + |psi|^2 = 0.970 +==== e( 9) = 3.53934 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.990 +==== e( 10) = 3.54036 eV ==== + psi = 0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.035*[# 1]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15] + +0.020*[# 31]+0.020*[# 32]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30] + +0.017*[# 9]+0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.012*[# 5] + +0.012*[# 13]+0.012*[# 29] + |psi|^2 = 0.728 +==== e( 11) = 4.50427 eV ==== + psi = 0.071*[# 6]+0.071*[# 8]+0.071*[# 14]+0.071*[# 15]+0.071*[# 31] + +0.071*[# 32]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.004*[# 7]+0.004*[# 16]+0.004*[# 30] + |psi|^2 = 1.149 +==== e( 12) = 4.50435 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.058*[# 2]+0.058*[# 3] + +0.058*[# 4]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.013*[# 6]+0.013*[# 8] + +0.013*[# 14]+0.013*[# 15]+0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.887 +==== e( 13) = 4.57402 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.024*[# 1]+0.017*[# 2] + +0.017*[# 3]+0.017*[# 4]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29] + |psi|^2 = 0.987 +==== e( 14) = 4.57418 eV ==== + psi = 0.101*[# 7]+0.101*[# 16]+0.101*[# 30]+0.055*[# 10]+0.055*[# 11] + +0.055*[# 12]+0.055*[# 18]+0.055*[# 19]+0.055*[# 20]+0.055*[# 22] + +0.055*[# 23]+0.055*[# 24]+0.055*[# 26]+0.055*[# 27]+0.055*[# 28] + +0.055*[# 2]+0.055*[# 3]+0.055*[# 4]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.016*[# 5] + +0.016*[# 13]+0.016*[# 29]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25] + |psi|^2 = 1.414 +==== e( 15) = 4.74870 eV ==== + psi = 0.049*[# 7]+0.049*[# 16]+0.049*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 31] + +0.027*[# 32]+0.005*[# 2]+0.005*[# 3]+0.005*[# 4] + |psi|^2 = 0.648 +==== e( 16) = 4.74983 eV ==== + psi = 0.090*[# 2]+0.090*[# 3]+0.090*[# 4]+0.045*[# 10]+0.045*[# 11] + +0.045*[# 12]+0.045*[# 18]+0.045*[# 19]+0.045*[# 20]+0.045*[# 22] + +0.045*[# 23]+0.045*[# 24]+0.045*[# 26]+0.045*[# 27]+0.045*[# 28] + +0.044*[# 6]+0.044*[# 8]+0.044*[# 14]+0.044*[# 15]+0.044*[# 31] + +0.044*[# 32]+0.001*[# 7]+0.001*[# 16]+0.001*[# 30] + |psi|^2 = 1.075 + + k = 0.6666666667 0.3333333333 0.3333333333 +==== e( 1) = -4.44567 eV ==== + psi = 0.093*[# 5]+0.093*[# 9]+0.093*[# 13]+0.093*[# 17]+0.093*[# 21] + +0.093*[# 25]+0.093*[# 29]+0.092*[# 1]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4]+0.011*[# 6]+0.011*[# 7]+0.011*[# 8]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 16] + +0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23] + +0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.011*[# 30] + +0.011*[# 31]+0.011*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4] + +0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15]+0.012*[# 31] + +0.012*[# 32]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12]+0.011*[# 18] + +0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24] + +0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 1.000 +==== e( 3) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14] + +0.013*[# 15]+0.013*[# 31]+0.013*[# 32]+0.012*[# 2]+0.012*[# 3] + +0.012*[# 4]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.974 +==== e( 4) = -3.32159 eV ==== + psi = 0.272*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.030*[# 5]+0.030*[# 13]+0.030*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18] + +0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24] + +0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 1.037 +==== e( 5) = -0.47745 eV ==== + psi = 0.124*[# 1]+0.081*[# 7]+0.081*[# 16]+0.081*[# 30]+0.041*[# 9] + +0.041*[# 17]+0.041*[# 21]+0.041*[# 25]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.014*[# 5]+0.014*[# 13]+0.014*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.990 +==== e( 6) = -0.47735 eV ==== + psi = 0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.041*[# 9]+0.041*[# 17] + +0.041*[# 21]+0.041*[# 25]+0.039*[# 6]+0.039*[# 8]+0.039*[# 14] + +0.039*[# 15]+0.039*[# 31]+0.039*[# 32]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.990 +==== e( 7) = -0.47735 eV ==== + psi = 0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.041*[# 9]+0.041*[# 17] + +0.041*[# 21]+0.041*[# 25]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.035*[# 2]+0.035*[# 3] + +0.035*[# 4]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + |psi|^2 = 0.990 +==== e( 8) = 0.79675 eV ==== + psi = 0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.039*[# 1]+0.039*[# 5] + +0.039*[# 9]+0.039*[# 13]+0.039*[# 17]+0.039*[# 21]+0.039*[# 25] + +0.039*[# 29]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.021*[# 7] + +0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.982 +==== e( 9) = 3.35691 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4] + |psi|^2 = 0.991 +==== e( 10) = 3.35691 eV ==== + psi = 0.047*[# 7]+0.047*[# 16]+0.047*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4] + |psi|^2 = 0.971 +==== e( 11) = 3.35799 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.052*[# 1]+0.034*[# 10] + +0.034*[# 11]+0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.028*[# 6]+0.028*[# 8]+0.028*[# 14]+0.028*[# 15] + +0.028*[# 31]+0.028*[# 32]+0.018*[# 7]+0.018*[# 16]+0.018*[# 30] + +0.017*[# 9]+0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 0.945 +==== e( 12) = 4.37538 eV ==== + psi = 0.072*[# 6]+0.072*[# 8]+0.072*[# 14]+0.072*[# 15]+0.072*[# 31] + +0.072*[# 32]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.020*[# 7]+0.020*[# 16] + +0.020*[# 30]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + |psi|^2 = 1.010 +==== e( 13) = 4.37596 eV ==== + psi = 0.062*[# 7]+0.062*[# 16]+0.062*[# 30]+0.062*[# 2]+0.062*[# 3] + +0.062*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.990 +==== e( 14) = 4.37596 eV ==== + psi = 0.082*[# 2]+0.082*[# 3]+0.082*[# 4]+0.051*[# 7]+0.051*[# 16] + +0.051*[# 30]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.029*[# 6]+0.029*[# 8] + +0.029*[# 14]+0.029*[# 15]+0.029*[# 31]+0.029*[# 32] + |psi|^2 = 1.150 +==== e( 15) = 5.16112 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.046*[# 7]+0.046*[# 16] + +0.046*[# 30]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32] + |psi|^2 = 1.050 +==== e( 16) = 5.16112 eV ==== + psi = 0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 31] + +0.032*[# 32]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + |psi|^2 = 0.764 + + k = 0.8333333333 0.3333333333 0.3333333333 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15]+0.010*[# 31] + +0.010*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.883 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30]+0.011*[# 6]+0.011*[# 8]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 18]+0.011*[# 19] + +0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26] + +0.011*[# 27]+0.011*[# 28]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2] + +0.009*[# 3]+0.009*[# 4] + |psi|^2 = 0.963 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.013*[# 7]+0.013*[# 16] + +0.013*[# 30] + |psi|^2 = 1.093 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.019*[# 2] + +0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.991 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.031*[# 2]+0.031*[# 3] + +0.031*[# 4]+0.025*[# 7]+0.025*[# 16]+0.025*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 1.160 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.055*[# 7]+0.055*[# 16]+0.055*[# 30]+0.055*[# 6]+0.055*[# 8] + +0.055*[# 14]+0.055*[# 15]+0.055*[# 31]+0.055*[# 32]+0.042*[# 10] + +0.042*[# 11]+0.042*[# 12]+0.042*[# 18]+0.042*[# 19]+0.042*[# 20] + +0.042*[# 22]+0.042*[# 23]+0.042*[# 24]+0.042*[# 26]+0.042*[# 27] + +0.042*[# 28]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4] + |psi|^2 = 1.016 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.034*[# 6]+0.034*[# 8] + +0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.804 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.020*[# 6]+0.020*[# 7] + +0.020*[# 8]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 14] + +0.020*[# 15]+0.020*[# 16]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.020*[# 30]+0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.492 + + k = 0.0000000000 0.5000000000 0.3333333333 +==== e( 1) = -4.30426 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.30321 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19]+0.009*[# 20] + +0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26]+0.009*[# 27] + +0.009*[# 28]+0.001*[# 2]+0.001*[# 3]+0.001*[# 4]+0.001*[# 7] + +0.001*[# 16]+0.001*[# 30] + |psi|^2 = 0.931 +==== e( 3) = -3.08338 eV ==== + psi = 0.113*[# 5]+0.113*[# 13]+0.113*[# 29]+0.084*[# 9]+0.084*[# 17] + +0.084*[# 21]+0.084*[# 25]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.889 +==== e( 4) = -3.08238 eV ==== + psi = 0.169*[# 1]+0.084*[# 9]+0.084*[# 17]+0.084*[# 21]+0.084*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.009*[# 6]+0.009*[# 8] + +0.009*[# 14]+0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30]+0.006*[# 10]+0.006*[# 11]+0.006*[# 12] + +0.006*[# 18]+0.006*[# 19]+0.006*[# 20]+0.006*[# 22]+0.006*[# 23] + +0.006*[# 24]+0.006*[# 26]+0.006*[# 27]+0.006*[# 28] + |psi|^2 = 0.826 +==== e( 5) = -0.06735 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.060*[# 9]+0.060*[# 17] + +0.060*[# 21]+0.060*[# 25]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + +0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19] + +0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26] + +0.021*[# 27]+0.021*[# 28]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 16]+0.018*[# 30]+0.018*[# 31] + +0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.06705 eV ==== + psi = 0.121*[# 1]+0.060*[# 9]+0.060*[# 17]+0.060*[# 21]+0.060*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20] + +0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27] + +0.027*[# 28]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4]+0.024*[# 7] + +0.024*[# 16]+0.024*[# 30] + |psi|^2 = 1.138 +==== e( 7) = 1.46284 eV ==== + psi = 0.102*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30]+0.012*[# 2] + +0.012*[# 3]+0.012*[# 4] + |psi|^2 = 1.009 +==== e( 8) = 1.46285 eV ==== + psi = 0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30] + +0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.031*[# 10]+0.031*[# 11] + +0.031*[# 12]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22] + +0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + +0.022*[# 6]+0.022*[# 8]+0.022*[# 14]+0.022*[# 15]+0.022*[# 31] + +0.022*[# 32] + |psi|^2 = 1.154 +==== e( 9) = 1.95717 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 1.95751 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.061*[# 7]+0.061*[# 16] + +0.061*[# 30]+0.049*[# 10]+0.049*[# 11]+0.049*[# 12]+0.049*[# 18] + +0.049*[# 19]+0.049*[# 20]+0.049*[# 22]+0.049*[# 23]+0.049*[# 24] + +0.049*[# 26]+0.049*[# 27]+0.049*[# 28]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 14]+0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 1.223 +==== e( 11) = 3.02286 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.020*[# 1]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.007*[# 5]+0.007*[# 13]+0.007*[# 29] + |psi|^2 = 0.956 +==== e( 12) = 3.02323 eV ==== + psi = 0.092*[# 2]+0.092*[# 3]+0.092*[# 4]+0.046*[# 10]+0.046*[# 11] + +0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20]+0.046*[# 22] + +0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27]+0.046*[# 28] + +0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15]+0.040*[# 31] + +0.040*[# 32]+0.013*[# 5]+0.013*[# 13]+0.013*[# 29]+0.013*[# 7] + +0.013*[# 16]+0.013*[# 30]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25] + |psi|^2 = 1.186 +==== e( 13) = 4.06622 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 4.06644 eV ==== + psi = 0.044*[# 6]+0.044*[# 8]+0.044*[# 14]+0.044*[# 15]+0.044*[# 31] + +0.044*[# 32]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.611 +==== e( 15) = 4.88257 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.034*[# 7]+0.034*[# 16]+0.034*[# 30]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.966 +==== e( 16) = 4.88277 eV ==== + psi = 0.041*[# 6]+0.041*[# 8]+0.041*[# 14]+0.041*[# 15]+0.041*[# 31] + +0.041*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30]+0.004*[# 1]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.001*[# 5]+0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.588 + + k = 0.1666666667 0.5000000000 0.3333333333 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.017*[# 6]+0.017*[# 8] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19]+0.010*[# 20] + +0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26]+0.010*[# 27] + +0.010*[# 28]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 0.950 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.911 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15] + +0.008*[# 31]+0.008*[# 32]+0.007*[# 10]+0.007*[# 11]+0.007*[# 12] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.867 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.029*[# 10] + +0.029*[# 11]+0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.025*[# 2]+0.025*[# 3]+0.025*[# 4]+0.025*[# 7] + +0.025*[# 16]+0.025*[# 30] + |psi|^2 = 1.088 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.037*[# 7]+0.037*[# 16]+0.037*[# 30] + +0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.019*[# 1]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.987 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.039*[# 6]+0.039*[# 8]+0.039*[# 14]+0.039*[# 15]+0.039*[# 31] + +0.039*[# 32]+0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.033*[# 2] + +0.033*[# 3]+0.033*[# 4]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.012*[# 7] + +0.012*[# 16]+0.012*[# 30] + |psi|^2 = 1.084 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 7]+0.049*[# 16] + +0.049*[# 30]+0.045*[# 10]+0.045*[# 11]+0.045*[# 12]+0.045*[# 18] + +0.045*[# 19]+0.045*[# 20]+0.045*[# 22]+0.045*[# 23]+0.045*[# 24] + +0.045*[# 26]+0.045*[# 27]+0.045*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.029*[# 1] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 1.196 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 1.047 +==== e( 12) = 3.70168 eV ==== + psi = 0.073*[# 2]+0.073*[# 3]+0.073*[# 4]+0.056*[# 6]+0.056*[# 8] + +0.056*[# 14]+0.056*[# 15]+0.056*[# 31]+0.056*[# 32]+0.047*[# 10] + +0.047*[# 11]+0.047*[# 12]+0.047*[# 18]+0.047*[# 19]+0.047*[# 20] + +0.047*[# 22]+0.047*[# 23]+0.047*[# 24]+0.047*[# 26]+0.047*[# 27] + +0.047*[# 28]+0.028*[# 1]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.010*[# 5]+0.010*[# 13]+0.010*[# 29]+0.005*[# 7] + +0.005*[# 16]+0.005*[# 30] + |psi|^2 = 1.251 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.002*[# 1] + + |psi|^2 = 0.677 +==== e( 15) = 4.84656 eV ==== + psi = 0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.879 +==== e( 16) = 4.84692 eV ==== + psi = 0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 18] + +0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23]+0.023*[# 24] + +0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30]+0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.566 + + k = 0.3333333333 0.5000000000 0.3333333333 +==== e( 1) = -3.94104 eV ==== + psi = 0.122*[# 5]+0.122*[# 13]+0.122*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.94002 eV ==== + psi = 0.182*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.061*[# 5]+0.061*[# 13]+0.061*[# 29]+0.016*[# 6]+0.016*[# 8] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 31]+0.016*[# 32]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20] + +0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27] + +0.011*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.994 +==== e( 3) = -3.23789 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.094*[# 9]+0.094*[# 17] + +0.094*[# 21]+0.094*[# 25]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14] + +0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18] + +0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24] + +0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.962 +==== e( 4) = -3.23693 eV ==== + psi = 0.189*[# 1]+0.094*[# 9]+0.094*[# 17]+0.094*[# 21]+0.094*[# 25] + +0.063*[# 5]+0.063*[# 13]+0.063*[# 29]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30]+0.010*[# 2]+0.010*[# 3]+0.010*[# 4]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19]+0.009*[# 20] + +0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26]+0.009*[# 27] + +0.009*[# 28]+0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15] + +0.006*[# 31]+0.006*[# 32] + |psi|^2 = 0.962 +==== e( 5) = -0.73636 eV ==== + psi = 0.073*[# 1]+0.058*[# 7]+0.058*[# 16]+0.058*[# 30]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.024*[# 5]+0.024*[# 13]+0.024*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.018*[# 2] + +0.018*[# 3]+0.018*[# 4] + |psi|^2 = 0.989 +==== e( 6) = -0.73621 eV ==== + psi = 0.048*[# 5]+0.048*[# 13]+0.048*[# 29]+0.038*[# 6]+0.038*[# 8] + +0.038*[# 14]+0.038*[# 15]+0.038*[# 31]+0.038*[# 32]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 7]+0.020*[# 16] + +0.020*[# 30] + |psi|^2 = 0.989 +==== e( 7) = 0.03076 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.039*[# 9]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.038*[# 2]+0.038*[# 3]+0.038*[# 4] + +0.036*[# 7]+0.036*[# 16]+0.036*[# 30]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.016*[# 1] + |psi|^2 = 0.996 +==== e( 8) = 0.03135 eV ==== + psi = 0.062*[# 1]+0.039*[# 9]+0.039*[# 17]+0.039*[# 21]+0.039*[# 25] + +0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 14]+0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.031*[# 5] + +0.031*[# 13]+0.031*[# 29]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12] + +0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23] + +0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.001*[# 7] + +0.001*[# 16]+0.001*[# 30] + |psi|^2 = 0.996 +==== e( 9) = 3.53934 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.990 +==== e( 10) = 3.54036 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 7]+0.040*[# 16] + +0.040*[# 30]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 1]+0.031*[# 6] + +0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32] + +0.017*[# 9]+0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.012*[# 5] + +0.012*[# 13]+0.012*[# 29] + |psi|^2 = 0.990 +==== e( 11) = 4.50427 eV ==== + psi = 0.071*[# 6]+0.071*[# 8]+0.071*[# 14]+0.071*[# 15]+0.071*[# 31] + +0.071*[# 32]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.004*[# 7]+0.004*[# 16]+0.004*[# 30] + |psi|^2 = 1.149 +==== e( 12) = 4.50435 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.064*[# 7]+0.064*[# 16] + +0.064*[# 30]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32] + |psi|^2 = 1.149 +==== e( 13) = 4.57402 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.024*[# 1]+0.017*[# 2] + +0.017*[# 3]+0.017*[# 4]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29] + |psi|^2 = 0.987 +==== e( 14) = 4.57418 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.059*[# 7]+0.059*[# 16] + +0.059*[# 30]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.016*[# 5]+0.016*[# 13] + +0.016*[# 29]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25] + |psi|^2 = 0.987 +==== e( 15) = 4.74870 eV ==== + psi = 0.049*[# 7]+0.049*[# 16]+0.049*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 31] + +0.027*[# 32]+0.005*[# 2]+0.005*[# 3]+0.005*[# 4] + |psi|^2 = 0.648 +==== e( 16) = 4.74983 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31] + +0.027*[# 32]+0.008*[# 7]+0.008*[# 16]+0.008*[# 30] + |psi|^2 = 0.648 + + k = 0.5000000000 0.5000000000 0.3333333333 +==== e( 1) = -3.56633 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.009*[# 2]+0.009*[# 3]+0.009*[# 4] + +0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15]+0.007*[# 31] + +0.007*[# 32] + |psi|^2 = 0.995 +==== e( 2) = -3.56624 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15]+0.015*[# 31] + +0.015*[# 32]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12]+0.011*[# 18] + +0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24] + +0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + |psi|^2 = 1.028 +==== e( 3) = -3.56624 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15]+0.012*[# 31] + +0.012*[# 32]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28] + |psi|^2 = 0.995 +==== e( 4) = -3.56434 eV ==== + psi = 0.377*[# 1]+0.095*[# 9]+0.095*[# 17]+0.095*[# 21]+0.095*[# 25] + +0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12]+0.011*[# 18] + +0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24] + +0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.008*[# 6]+0.008*[# 8] + +0.008*[# 14]+0.008*[# 15]+0.008*[# 31]+0.008*[# 32] + |psi|^2 = 1.028 +==== e( 5) = -0.56737 eV ==== + psi = 0.107*[# 7]+0.107*[# 16]+0.107*[# 30]+0.058*[# 1]+0.035*[# 9] + +0.035*[# 17]+0.035*[# 21]+0.035*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.028*[# 5]+0.028*[# 13]+0.028*[# 29]+0.005*[# 2]+0.005*[# 3] + +0.005*[# 4]+0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.988 +==== e( 6) = -0.56683 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 31]+0.037*[# 32]+0.035*[# 9]+0.035*[# 17]+0.035*[# 21] + +0.035*[# 25]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + |psi|^2 = 0.949 +==== e( 7) = -0.56683 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.037*[# 2] + +0.037*[# 3]+0.037*[# 4]+0.035*[# 9]+0.035*[# 17]+0.035*[# 21] + +0.035*[# 25]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + |psi|^2 = 0.988 +==== e( 8) = -0.56653 eV ==== + psi = 0.084*[# 1]+0.035*[# 9]+0.035*[# 17]+0.035*[# 21]+0.035*[# 25] + +0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29] + |psi|^2 = 0.949 +==== e( 9) = 4.26946 eV ==== + psi = 0.142*[# 7]+0.142*[# 16]+0.142*[# 30]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.015*[# 5]+0.015*[# 13]+0.015*[# 29]+0.011*[# 9]+0.011*[# 17] + +0.011*[# 21]+0.011*[# 25]+0.003*[# 6]+0.003*[# 8]+0.003*[# 14] + +0.003*[# 15]+0.003*[# 31]+0.003*[# 32]+0.001*[# 2]+0.001*[# 3] + +0.001*[# 4] + |psi|^2 = 0.988 +==== e( 10) = 4.27017 eV ==== + psi = 0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.022*[# 10] + +0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20] + +0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27] + +0.022*[# 28]+0.015*[# 5]+0.015*[# 13]+0.015*[# 29]+0.011*[# 9] + +0.011*[# 17]+0.011*[# 21]+0.011*[# 25] + |psi|^2 = 0.612 +==== e( 11) = 4.27017 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.029*[# 2]+0.029*[# 3] + +0.029*[# 4]+0.015*[# 5]+0.015*[# 13]+0.015*[# 29]+0.011*[# 9] + +0.011*[# 17]+0.011*[# 21]+0.011*[# 25] + |psi|^2 = 0.988 +==== e( 12) = 4.27105 eV ==== + psi = 0.046*[# 1]+0.026*[# 6]+0.026*[# 8]+0.026*[# 14]+0.026*[# 15] + +0.026*[# 31]+0.026*[# 32]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4] + +0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19] + +0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26] + +0.022*[# 27]+0.022*[# 28]+0.011*[# 9]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30] + |psi|^2 = 0.612 +==== e( 13) = 4.92638 eV ==== + psi = 0.164*[# 7]+0.164*[# 16]+0.164*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.988 +==== e( 14) = 4.92678 eV ==== + psi = 0.123*[# 6]+0.123*[# 8]+0.123*[# 14]+0.123*[# 15]+0.123*[# 31] + +0.123*[# 32]+0.062*[# 10]+0.062*[# 11]+0.062*[# 12]+0.062*[# 18] + +0.062*[# 19]+0.062*[# 20]+0.062*[# 22]+0.062*[# 23]+0.062*[# 24] + +0.062*[# 26]+0.062*[# 27]+0.062*[# 28] + |psi|^2 = 1.482 +==== e( 15) = 4.92770 eV ==== + psi = 0.082*[# 2]+0.082*[# 3]+0.082*[# 4]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14]+0.041*[# 15] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.041*[# 31] + +0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 4.92770 eV ==== + psi = 0.082*[# 2]+0.082*[# 3]+0.082*[# 4]+0.082*[# 6]+0.082*[# 8] + +0.082*[# 14]+0.082*[# 15]+0.082*[# 31]+0.082*[# 32]+0.062*[# 10] + +0.062*[# 11]+0.062*[# 12]+0.062*[# 18]+0.062*[# 19]+0.062*[# 20] + +0.062*[# 22]+0.062*[# 23]+0.062*[# 24]+0.062*[# 26]+0.062*[# 27] + +0.062*[# 28] + |psi|^2 = 1.482 + + k = 0.6666666667 0.5000000000 0.3333333333 +==== e( 1) = -3.94104 eV ==== + psi = 0.122*[# 5]+0.122*[# 13]+0.122*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.94002 eV ==== + psi = 0.182*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.061*[# 5]+0.061*[# 13]+0.061*[# 29]+0.016*[# 6]+0.016*[# 8] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 31]+0.016*[# 32]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20] + +0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27] + +0.011*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.994 +==== e( 3) = -3.23789 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.094*[# 9]+0.094*[# 17] + +0.094*[# 21]+0.094*[# 25]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14] + +0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18] + +0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24] + +0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.962 +==== e( 4) = -3.23693 eV ==== + psi = 0.189*[# 1]+0.094*[# 9]+0.094*[# 17]+0.094*[# 21]+0.094*[# 25] + +0.063*[# 5]+0.063*[# 13]+0.063*[# 29]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30]+0.010*[# 2]+0.010*[# 3]+0.010*[# 4]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19]+0.009*[# 20] + +0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26]+0.009*[# 27] + +0.009*[# 28]+0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15] + +0.006*[# 31]+0.006*[# 32] + |psi|^2 = 0.962 +==== e( 5) = -0.73636 eV ==== + psi = 0.073*[# 1]+0.058*[# 7]+0.058*[# 16]+0.058*[# 30]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.024*[# 5]+0.024*[# 13]+0.024*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.018*[# 2] + +0.018*[# 3]+0.018*[# 4] + |psi|^2 = 0.989 +==== e( 6) = -0.73621 eV ==== + psi = 0.048*[# 5]+0.048*[# 13]+0.048*[# 29]+0.038*[# 6]+0.038*[# 8] + +0.038*[# 14]+0.038*[# 15]+0.038*[# 31]+0.038*[# 32]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 7]+0.020*[# 16] + +0.020*[# 30] + |psi|^2 = 0.989 +==== e( 7) = 0.03076 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.039*[# 9]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.038*[# 2]+0.038*[# 3]+0.038*[# 4] + +0.036*[# 7]+0.036*[# 16]+0.036*[# 30]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.016*[# 1] + |psi|^2 = 0.996 +==== e( 8) = 0.03135 eV ==== + psi = 0.062*[# 1]+0.039*[# 9]+0.039*[# 17]+0.039*[# 21]+0.039*[# 25] + +0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 14]+0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.031*[# 5] + +0.031*[# 13]+0.031*[# 29]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12] + +0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23] + +0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.001*[# 7] + +0.001*[# 16]+0.001*[# 30] + |psi|^2 = 0.996 +==== e( 9) = 3.53934 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.990 +==== e( 10) = 3.54036 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 7]+0.040*[# 16] + +0.040*[# 30]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 1]+0.031*[# 6] + +0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32] + +0.017*[# 9]+0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.012*[# 5] + +0.012*[# 13]+0.012*[# 29] + |psi|^2 = 0.990 +==== e( 11) = 4.50427 eV ==== + psi = 0.071*[# 6]+0.071*[# 8]+0.071*[# 14]+0.071*[# 15]+0.071*[# 31] + +0.071*[# 32]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.004*[# 7]+0.004*[# 16]+0.004*[# 30] + |psi|^2 = 1.149 +==== e( 12) = 4.50435 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.064*[# 7]+0.064*[# 16] + +0.064*[# 30]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32] + |psi|^2 = 1.149 +==== e( 13) = 4.57402 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.024*[# 1]+0.017*[# 2] + +0.017*[# 3]+0.017*[# 4]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29] + |psi|^2 = 0.987 +==== e( 14) = 4.57418 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.059*[# 7]+0.059*[# 16] + +0.059*[# 30]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.016*[# 5]+0.016*[# 13] + +0.016*[# 29]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25] + |psi|^2 = 0.987 +==== e( 15) = 4.74870 eV ==== + psi = 0.049*[# 7]+0.049*[# 16]+0.049*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 31] + +0.027*[# 32]+0.005*[# 2]+0.005*[# 3]+0.005*[# 4] + |psi|^2 = 0.648 +==== e( 16) = 4.74983 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31] + +0.027*[# 32]+0.008*[# 7]+0.008*[# 16]+0.008*[# 30] + |psi|^2 = 0.648 + + k = 0.8333333333 0.5000000000 0.3333333333 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.017*[# 6]+0.017*[# 8] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19]+0.010*[# 20] + +0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26]+0.010*[# 27] + +0.010*[# 28]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 0.950 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.911 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15] + +0.008*[# 31]+0.008*[# 32]+0.007*[# 10]+0.007*[# 11]+0.007*[# 12] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.867 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.029*[# 10] + +0.029*[# 11]+0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.025*[# 2]+0.025*[# 3]+0.025*[# 4]+0.025*[# 7] + +0.025*[# 16]+0.025*[# 30] + |psi|^2 = 1.088 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.037*[# 7]+0.037*[# 16]+0.037*[# 30] + +0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.019*[# 1]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.987 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.039*[# 6]+0.039*[# 8]+0.039*[# 14]+0.039*[# 15]+0.039*[# 31] + +0.039*[# 32]+0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.033*[# 2] + +0.033*[# 3]+0.033*[# 4]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.012*[# 7] + +0.012*[# 16]+0.012*[# 30] + |psi|^2 = 1.084 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 7]+0.049*[# 16] + +0.049*[# 30]+0.045*[# 10]+0.045*[# 11]+0.045*[# 12]+0.045*[# 18] + +0.045*[# 19]+0.045*[# 20]+0.045*[# 22]+0.045*[# 23]+0.045*[# 24] + +0.045*[# 26]+0.045*[# 27]+0.045*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.029*[# 1] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 1.196 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 1.047 +==== e( 12) = 3.70168 eV ==== + psi = 0.073*[# 2]+0.073*[# 3]+0.073*[# 4]+0.056*[# 6]+0.056*[# 8] + +0.056*[# 14]+0.056*[# 15]+0.056*[# 31]+0.056*[# 32]+0.047*[# 10] + +0.047*[# 11]+0.047*[# 12]+0.047*[# 18]+0.047*[# 19]+0.047*[# 20] + +0.047*[# 22]+0.047*[# 23]+0.047*[# 24]+0.047*[# 26]+0.047*[# 27] + +0.047*[# 28]+0.028*[# 1]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.010*[# 5]+0.010*[# 13]+0.010*[# 29]+0.005*[# 7] + +0.005*[# 16]+0.005*[# 30] + |psi|^2 = 1.251 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.002*[# 1] + + |psi|^2 = 0.677 +==== e( 15) = 4.84656 eV ==== + psi = 0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.879 +==== e( 16) = 4.84692 eV ==== + psi = 0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 18] + +0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23]+0.023*[# 24] + +0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30]+0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.566 + + k = 0.0000000000 0.6666666667 0.3333333333 +==== e( 1) = -4.87592 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.52951 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15]+0.009*[# 31] + +0.009*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.002*[# 7]+0.002*[# 16] + +0.002*[# 30] + |psi|^2 = 0.848 +==== e( 3) = -3.52873 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.54529 eV ==== + psi = 0.085*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.085*[# 5]+0.085*[# 13]+0.085*[# 29]+0.011*[# 7]+0.011*[# 16] + +0.011*[# 30]+0.010*[# 6]+0.010*[# 8]+0.010*[# 10]+0.010*[# 11] + +0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.010*[# 31]+0.010*[# 32]+0.009*[# 2] + +0.009*[# 3]+0.009*[# 4] + |psi|^2 = 0.929 +==== e( 5) = -0.62188 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.994 +==== e( 6) = 0.50951 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.061*[# 9]+0.061*[# 17] + +0.061*[# 21]+0.061*[# 25]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.016*[# 7]+0.016*[# 16] + +0.016*[# 30] + |psi|^2 = 1.178 +==== e( 7) = 0.50974 eV ==== + psi = 0.122*[# 1]+0.061*[# 9]+0.061*[# 17]+0.061*[# 21]+0.061*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.029*[# 2]+0.029*[# 3] + +0.029*[# 4]+0.029*[# 7]+0.029*[# 16]+0.029*[# 30]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.992 +==== e( 8) = 1.69051 eV ==== + psi = 0.045*[# 7]+0.045*[# 16]+0.045*[# 30]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.002*[# 1] + +0.002*[# 5]+0.002*[# 9]+0.002*[# 13]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.002*[# 29] + |psi|^2 = 0.892 +==== e( 9) = 2.43371 eV ==== + psi = 0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17]+0.043*[# 21] + +0.043*[# 25]+0.043*[# 29]+0.043*[# 1]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 0.987 +==== e( 10) = 2.54749 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.049*[# 2]+0.049*[# 3] + +0.049*[# 4]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.015*[# 1] + +0.008*[# 9]+0.008*[# 17]+0.008*[# 21]+0.008*[# 25]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29] + |psi|^2 = 0.981 +==== e( 11) = 2.54759 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29]+0.008*[# 9]+0.008*[# 17]+0.008*[# 21] + +0.008*[# 25] + |psi|^2 = 0.992 +==== e( 12) = 3.71718 eV ==== + psi = 0.070*[# 2]+0.070*[# 3]+0.070*[# 4]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 14]+0.050*[# 15] + +0.050*[# 18]+0.050*[# 19]+0.050*[# 20]+0.050*[# 22]+0.050*[# 23] + +0.050*[# 24]+0.050*[# 26]+0.050*[# 27]+0.050*[# 28]+0.050*[# 31] + +0.050*[# 32]+0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.277 +==== e( 13) = 3.84161 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 14]+0.050*[# 15]+0.050*[# 31]+0.050*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.002*[# 5]+0.002*[# 13]+0.002*[# 29]+0.001*[# 9] + +0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 3.84259 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.036*[# 7]+0.036*[# 16] + +0.036*[# 30]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 18] + +0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23]+0.034*[# 24] + +0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.822 +==== e( 15) = 4.03675 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.878 +==== e( 16) = 5.60339 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.029*[# 6]+0.029*[# 8] + +0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14]+0.029*[# 15] + +0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23] + +0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.029*[# 31] + +0.029*[# 32]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30] + |psi|^2 = 0.705 + + k = 0.1666666667 0.6666666667 0.3333333333 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15]+0.010*[# 31] + +0.010*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.883 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30]+0.011*[# 6]+0.011*[# 8]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 18]+0.011*[# 19] + +0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26] + +0.011*[# 27]+0.011*[# 28]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2] + +0.009*[# 3]+0.009*[# 4] + |psi|^2 = 0.963 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.013*[# 7]+0.013*[# 16] + +0.013*[# 30] + |psi|^2 = 1.093 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.019*[# 2] + +0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.991 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.031*[# 2]+0.031*[# 3] + +0.031*[# 4]+0.025*[# 7]+0.025*[# 16]+0.025*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 1.160 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.055*[# 7]+0.055*[# 16]+0.055*[# 30]+0.055*[# 6]+0.055*[# 8] + +0.055*[# 14]+0.055*[# 15]+0.055*[# 31]+0.055*[# 32]+0.042*[# 10] + +0.042*[# 11]+0.042*[# 12]+0.042*[# 18]+0.042*[# 19]+0.042*[# 20] + +0.042*[# 22]+0.042*[# 23]+0.042*[# 24]+0.042*[# 26]+0.042*[# 27] + +0.042*[# 28]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4] + |psi|^2 = 1.016 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.034*[# 6]+0.034*[# 8] + +0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.804 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.020*[# 6]+0.020*[# 7] + +0.020*[# 8]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 14] + +0.020*[# 15]+0.020*[# 16]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.020*[# 30]+0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.492 + + k = 0.3333333333 0.6666666667 0.3333333333 +==== e( 1) = -4.44567 eV ==== + psi = 0.093*[# 5]+0.093*[# 9]+0.093*[# 13]+0.093*[# 17]+0.093*[# 21] + +0.093*[# 25]+0.093*[# 29]+0.092*[# 1]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4]+0.011*[# 6]+0.011*[# 7]+0.011*[# 8]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 16] + +0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23] + +0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.011*[# 30] + +0.011*[# 31]+0.011*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14] + +0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.005*[# 7]+0.005*[# 16] + +0.005*[# 30] + |psi|^2 = 0.958 +==== e( 3) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.021*[# 2]+0.021*[# 3]+0.021*[# 4] + +0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15]+0.014*[# 31] + +0.014*[# 32]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12]+0.014*[# 18] + +0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24] + +0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 1.057 +==== e( 4) = -3.32159 eV ==== + psi = 0.272*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.030*[# 5]+0.030*[# 13]+0.030*[# 29]+0.017*[# 7]+0.017*[# 16] + +0.017*[# 30]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12]+0.011*[# 18] + +0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24] + +0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 14]+0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.008*[# 2] + +0.008*[# 3]+0.008*[# 4] + |psi|^2 = 0.995 +==== e( 5) = -0.47745 eV ==== + psi = 0.124*[# 1]+0.081*[# 7]+0.081*[# 16]+0.081*[# 30]+0.041*[# 9] + +0.041*[# 17]+0.041*[# 21]+0.041*[# 25]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.014*[# 5]+0.014*[# 13]+0.014*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.990 +==== e( 6) = -0.47735 eV ==== + psi = 0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.041*[# 9]+0.041*[# 17] + +0.041*[# 21]+0.041*[# 25]+0.040*[# 6]+0.040*[# 8]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.990 +==== e( 7) = -0.47735 eV ==== + psi = 0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.041*[# 9]+0.041*[# 17] + +0.041*[# 21]+0.041*[# 25]+0.039*[# 2]+0.039*[# 3]+0.039*[# 4] + +0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + |psi|^2 = 0.989 +==== e( 8) = 0.79675 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.025*[# 7] + +0.025*[# 16]+0.025*[# 30] + |psi|^2 = 0.982 +==== e( 9) = 3.35691 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4] + |psi|^2 = 0.991 +==== e( 10) = 3.35691 eV ==== + psi = 0.054*[# 6]+0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31] + +0.054*[# 32]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 18] + +0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23]+0.034*[# 24] + +0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.023*[# 5]+0.023*[# 13] + +0.023*[# 29]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4] + |psi|^2 = 0.965 +==== e( 11) = 3.35799 eV ==== + psi = 0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.052*[# 1]+0.040*[# 7] + +0.040*[# 16]+0.040*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12] + +0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23] + +0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.027*[# 6] + +0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32] + +0.017*[# 9]+0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 1.086 +==== e( 12) = 4.37538 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.024*[# 7]+0.024*[# 16] + +0.024*[# 30]+0.001*[# 2]+0.001*[# 3]+0.001*[# 4] + |psi|^2 = 0.875 +==== e( 13) = 4.37596 eV ==== + psi = 0.062*[# 7]+0.062*[# 16]+0.062*[# 30]+0.062*[# 2]+0.062*[# 3] + +0.062*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.990 +==== e( 14) = 4.37596 eV ==== + psi = 0.055*[# 2]+0.055*[# 3]+0.055*[# 4]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.036*[# 7]+0.036*[# 16]+0.036*[# 30]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32] + |psi|^2 = 0.937 +==== e( 15) = 5.16112 eV ==== + psi = 0.067*[# 2]+0.067*[# 3]+0.067*[# 4]+0.066*[# 7]+0.066*[# 16] + +0.066*[# 30]+0.053*[# 10]+0.053*[# 11]+0.053*[# 12]+0.053*[# 18] + +0.053*[# 19]+0.053*[# 20]+0.053*[# 22]+0.053*[# 23]+0.053*[# 24] + +0.053*[# 26]+0.053*[# 27]+0.053*[# 28]+0.039*[# 6]+0.039*[# 8] + +0.039*[# 14]+0.039*[# 15]+0.039*[# 31]+0.039*[# 32] + |psi|^2 = 1.261 +==== e( 16) = 5.16112 eV ==== + psi = 0.036*[# 2]+0.036*[# 3]+0.036*[# 4]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 31] + +0.032*[# 32]+0.028*[# 7]+0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.766 + + k = 0.5000000000 0.6666666667 0.3333333333 +==== e( 1) = -3.94104 eV ==== + psi = 0.122*[# 5]+0.122*[# 13]+0.122*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.94002 eV ==== + psi = 0.182*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.061*[# 5]+0.061*[# 13]+0.061*[# 29]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.015*[# 2] + +0.015*[# 3]+0.015*[# 4]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.004*[# 7] + +0.004*[# 16]+0.004*[# 30] + |psi|^2 = 1.079 +==== e( 3) = -3.23789 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.094*[# 9]+0.094*[# 17] + +0.094*[# 21]+0.094*[# 25]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14] + +0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18] + +0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24] + +0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.962 +==== e( 4) = -3.23693 eV ==== + psi = 0.189*[# 1]+0.094*[# 9]+0.094*[# 17]+0.094*[# 21]+0.094*[# 25] + +0.063*[# 5]+0.063*[# 13]+0.063*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 14]+0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.008*[# 2] + +0.008*[# 3]+0.008*[# 4] + |psi|^2 = 1.047 +==== e( 5) = -0.73636 eV ==== + psi = 0.073*[# 1]+0.058*[# 7]+0.058*[# 16]+0.058*[# 30]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.024*[# 5]+0.024*[# 13]+0.024*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.018*[# 2] + +0.018*[# 3]+0.018*[# 4] + |psi|^2 = 0.989 +==== e( 6) = -0.73621 eV ==== + psi = 0.048*[# 5]+0.048*[# 13]+0.048*[# 29]+0.038*[# 2]+0.038*[# 3] + +0.038*[# 4]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 31]+0.037*[# 32]+0.036*[# 9]+0.036*[# 17]+0.036*[# 21] + +0.036*[# 25]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + |psi|^2 = 0.963 +==== e( 7) = 0.03076 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.039*[# 9]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.038*[# 2]+0.038*[# 3]+0.038*[# 4] + +0.036*[# 7]+0.036*[# 16]+0.036*[# 30]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.016*[# 1] + |psi|^2 = 0.996 +==== e( 8) = 0.03135 eV ==== + psi = 0.062*[# 1]+0.039*[# 9]+0.039*[# 17]+0.039*[# 21]+0.039*[# 25] + +0.036*[# 6]+0.036*[# 8]+0.036*[# 14]+0.036*[# 15]+0.036*[# 31] + +0.036*[# 32]+0.031*[# 5]+0.031*[# 13]+0.031*[# 29]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20] + +0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27] + +0.027*[# 28]+0.019*[# 2]+0.019*[# 3]+0.019*[# 4]+0.019*[# 7] + +0.019*[# 16]+0.019*[# 30] + |psi|^2 = 0.970 +==== e( 9) = 3.53934 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.990 +==== e( 10) = 3.54036 eV ==== + psi = 0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.035*[# 1]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15] + +0.020*[# 31]+0.020*[# 32]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30] + +0.017*[# 9]+0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.012*[# 5] + +0.012*[# 13]+0.012*[# 29] + |psi|^2 = 0.728 +==== e( 11) = 4.50427 eV ==== + psi = 0.071*[# 6]+0.071*[# 8]+0.071*[# 14]+0.071*[# 15]+0.071*[# 31] + +0.071*[# 32]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.004*[# 7]+0.004*[# 16]+0.004*[# 30] + |psi|^2 = 1.149 +==== e( 12) = 4.50435 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.058*[# 2]+0.058*[# 3] + +0.058*[# 4]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.013*[# 6]+0.013*[# 8] + +0.013*[# 14]+0.013*[# 15]+0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.887 +==== e( 13) = 4.57402 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.024*[# 1]+0.017*[# 2] + +0.017*[# 3]+0.017*[# 4]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29] + |psi|^2 = 0.987 +==== e( 14) = 4.57418 eV ==== + psi = 0.101*[# 7]+0.101*[# 16]+0.101*[# 30]+0.055*[# 10]+0.055*[# 11] + +0.055*[# 12]+0.055*[# 18]+0.055*[# 19]+0.055*[# 20]+0.055*[# 22] + +0.055*[# 23]+0.055*[# 24]+0.055*[# 26]+0.055*[# 27]+0.055*[# 28] + +0.055*[# 2]+0.055*[# 3]+0.055*[# 4]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.016*[# 5] + +0.016*[# 13]+0.016*[# 29]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25] + |psi|^2 = 1.414 +==== e( 15) = 4.74870 eV ==== + psi = 0.049*[# 7]+0.049*[# 16]+0.049*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 31] + +0.027*[# 32]+0.005*[# 2]+0.005*[# 3]+0.005*[# 4] + |psi|^2 = 0.648 +==== e( 16) = 4.74983 eV ==== + psi = 0.090*[# 2]+0.090*[# 3]+0.090*[# 4]+0.045*[# 10]+0.045*[# 11] + +0.045*[# 12]+0.045*[# 18]+0.045*[# 19]+0.045*[# 20]+0.045*[# 22] + +0.045*[# 23]+0.045*[# 24]+0.045*[# 26]+0.045*[# 27]+0.045*[# 28] + +0.044*[# 6]+0.044*[# 8]+0.044*[# 14]+0.044*[# 15]+0.044*[# 31] + +0.044*[# 32]+0.001*[# 7]+0.001*[# 16]+0.001*[# 30] + |psi|^2 = 1.075 + + k = 0.6666666667 0.6666666667 0.3333333333 +==== e( 1) = -4.44567 eV ==== + psi = 0.093*[# 5]+0.093*[# 9]+0.093*[# 13]+0.093*[# 17]+0.093*[# 21] + +0.093*[# 25]+0.093*[# 29]+0.092*[# 1]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4]+0.011*[# 6]+0.011*[# 7]+0.011*[# 8]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 16] + +0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23] + +0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.011*[# 30] + +0.011*[# 31]+0.011*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18] + +0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24] + +0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 1.026 +==== e( 3) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14] + +0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.002*[# 7]+0.002*[# 16] + +0.002*[# 30] + |psi|^2 = 0.921 +==== e( 4) = -3.32159 eV ==== + psi = 0.272*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.030*[# 5]+0.030*[# 13]+0.030*[# 29]+0.024*[# 7]+0.024*[# 16] + +0.024*[# 30]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18] + +0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24] + +0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.012*[# 2]+0.012*[# 3] + +0.012*[# 4]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 1.030 +==== e( 5) = -0.47745 eV ==== + psi = 0.124*[# 1]+0.081*[# 7]+0.081*[# 16]+0.081*[# 30]+0.041*[# 9] + +0.041*[# 17]+0.041*[# 21]+0.041*[# 25]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.014*[# 5]+0.014*[# 13]+0.014*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.990 +==== e( 6) = -0.47735 eV ==== + psi = 0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.041*[# 9]+0.041*[# 17] + +0.041*[# 21]+0.041*[# 25]+0.039*[# 6]+0.039*[# 8]+0.039*[# 14] + +0.039*[# 15]+0.039*[# 31]+0.039*[# 32]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.990 +==== e( 7) = -0.47735 eV ==== + psi = 0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.041*[# 9]+0.041*[# 17] + +0.041*[# 21]+0.041*[# 25]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.036*[# 2]+0.036*[# 3] + +0.036*[# 4]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + |psi|^2 = 0.990 +==== e( 8) = 0.79675 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.036*[# 2]+0.036*[# 3] + +0.036*[# 4]+0.028*[# 7]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12] + +0.028*[# 16]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.028*[# 30]+0.024*[# 6]+0.024*[# 8]+0.024*[# 14]+0.024*[# 15] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.982 +==== e( 9) = 3.35691 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4] + |psi|^2 = 0.991 +==== e( 10) = 3.35691 eV ==== + psi = 0.049*[# 6]+0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 31] + +0.049*[# 32]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 18] + +0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23]+0.032*[# 24] + +0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.023*[# 5]+0.023*[# 13] + +0.023*[# 29]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4] + |psi|^2 = 0.900 +==== e( 11) = 3.35799 eV ==== + psi = 0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.052*[# 1]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30]+0.027*[# 6] + +0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32] + +0.017*[# 9]+0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 1.071 +==== e( 12) = 4.37538 eV ==== + psi = 0.065*[# 6]+0.065*[# 8]+0.065*[# 14]+0.065*[# 15]+0.065*[# 31] + +0.065*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.025*[# 7]+0.025*[# 16] + +0.025*[# 30]+0.004*[# 2]+0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.955 +==== e( 13) = 4.37596 eV ==== + psi = 0.062*[# 7]+0.062*[# 16]+0.062*[# 30]+0.062*[# 2]+0.062*[# 3] + +0.062*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.990 +==== e( 14) = 4.37596 eV ==== + psi = 0.057*[# 7]+0.057*[# 16]+0.057*[# 30]+0.050*[# 2]+0.050*[# 3] + +0.050*[# 4]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.892 +==== e( 15) = 5.16112 eV ==== + psi = 0.045*[# 2]+0.045*[# 3]+0.045*[# 4]+0.045*[# 7]+0.045*[# 16] + +0.045*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 14]+0.037*[# 15]+0.037*[# 31]+0.037*[# 32] + |psi|^2 = 0.983 +==== e( 16) = 5.16112 eV ==== + psi = 0.063*[# 2]+0.063*[# 3]+0.063*[# 4]+0.045*[# 6]+0.045*[# 8] + +0.045*[# 10]+0.045*[# 11]+0.045*[# 12]+0.045*[# 14]+0.045*[# 15] + +0.045*[# 18]+0.045*[# 19]+0.045*[# 20]+0.045*[# 22]+0.045*[# 23] + +0.045*[# 24]+0.045*[# 26]+0.045*[# 27]+0.045*[# 28]+0.045*[# 31] + +0.045*[# 32]+0.028*[# 7]+0.028*[# 16]+0.028*[# 30] + |psi|^2 = 1.089 + + k = 0.8333333333 0.6666666667 0.3333333333 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15]+0.010*[# 31] + +0.010*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.883 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30]+0.011*[# 6]+0.011*[# 8]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 18]+0.011*[# 19] + +0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26] + +0.011*[# 27]+0.011*[# 28]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2] + +0.009*[# 3]+0.009*[# 4] + |psi|^2 = 0.963 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.013*[# 7]+0.013*[# 16] + +0.013*[# 30] + |psi|^2 = 1.093 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.019*[# 2] + +0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.991 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.031*[# 2]+0.031*[# 3] + +0.031*[# 4]+0.025*[# 7]+0.025*[# 16]+0.025*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 1.160 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.055*[# 7]+0.055*[# 16]+0.055*[# 30]+0.055*[# 6]+0.055*[# 8] + +0.055*[# 14]+0.055*[# 15]+0.055*[# 31]+0.055*[# 32]+0.042*[# 10] + +0.042*[# 11]+0.042*[# 12]+0.042*[# 18]+0.042*[# 19]+0.042*[# 20] + +0.042*[# 22]+0.042*[# 23]+0.042*[# 24]+0.042*[# 26]+0.042*[# 27] + +0.042*[# 28]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4] + |psi|^2 = 1.016 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.034*[# 6]+0.034*[# 8] + +0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.804 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.020*[# 6]+0.020*[# 7] + +0.020*[# 8]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 14] + +0.020*[# 15]+0.020*[# 16]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.020*[# 30]+0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.492 + + k = 0.0000000000 0.8333333333 0.3333333333 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1] + |psi|^2 = 0.679 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 7]+0.027*[# 8]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 16] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 30] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 1.296 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.980 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 6]+0.032*[# 7]+0.032*[# 8]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15]+0.032*[# 16] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 30] + +0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.332 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.596 +==== e( 8) = 1.85450 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.032*[# 6]+0.032*[# 7] + +0.032*[# 8]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 14] + +0.032*[# 15]+0.032*[# 16]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28]+0.032*[# 30]+0.032*[# 31]+0.032*[# 32] + |psi|^2 = 0.767 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.042*[# 2]+0.042*[# 3]+0.042*[# 4]+0.042*[# 6]+0.042*[# 7] + +0.042*[# 8]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 14] + +0.042*[# 15]+0.042*[# 16]+0.042*[# 18]+0.042*[# 19]+0.042*[# 20] + +0.042*[# 22]+0.042*[# 23]+0.042*[# 24]+0.042*[# 26]+0.042*[# 27] + +0.042*[# 28]+0.042*[# 30]+0.042*[# 31]+0.042*[# 32] + |psi|^2 = 1.013 +==== e( 11) = 3.29155 eV ==== + psi = 0.055*[# 6]+0.055*[# 7]+0.055*[# 8]+0.055*[# 14]+0.055*[# 15] + +0.055*[# 16]+0.055*[# 31]+0.055*[# 32]+0.055*[# 10]+0.055*[# 12] + +0.055*[# 11]+0.055*[# 18]+0.055*[# 19]+0.055*[# 20]+0.055*[# 30] + +0.055*[# 22]+0.055*[# 23]+0.055*[# 24]+0.055*[# 26]+0.055*[# 27] + +0.055*[# 28]+0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.349 +==== e( 12) = 3.36033 eV ==== + psi = 0.036*[# 2]+0.036*[# 3]+0.036*[# 4]+0.036*[# 7]+0.036*[# 16] + +0.036*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.036*[# 6]+0.036*[# 8] + +0.036*[# 14]+0.036*[# 15]+0.036*[# 31]+0.036*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.879 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.043*[# 7]+0.043*[# 16] + +0.043*[# 30]+0.043*[# 6]+0.043*[# 8]+0.043*[# 10]+0.043*[# 11] + +0.043*[# 12]+0.043*[# 14]+0.043*[# 15]+0.043*[# 18]+0.043*[# 19] + +0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24]+0.043*[# 26] + +0.043*[# 27]+0.043*[# 28]+0.043*[# 31]+0.043*[# 32] + |psi|^2 = 1.026 +==== e( 15) = 4.50839 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.009 +==== e( 16) = 5.45761 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14]+0.041*[# 15] + +0.041*[# 7]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 32] + +0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 30]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.015 + + k = 0.1666666667 0.8333333333 0.3333333333 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.730 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.025*[# 31]+0.025*[# 32]+0.025*[# 7]+0.025*[# 16] + +0.025*[# 30] + |psi|^2 = 1.271 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 10]+0.014*[# 11] + +0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 18]+0.014*[# 19] + +0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26] + +0.014*[# 27]+0.014*[# 28]+0.014*[# 31]+0.014*[# 32]+0.013*[# 2] + +0.013*[# 3]+0.013*[# 4] + |psi|^2 = 0.990 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.041*[# 7]+0.041*[# 16] + +0.041*[# 30]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 18] + +0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24] + +0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.133 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.742 +==== e( 8) = 2.16363 eV ==== + psi = 0.043*[# 7]+0.043*[# 16]+0.043*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.899 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 7]+0.038*[# 16] + +0.038*[# 30]+0.036*[# 1]+0.036*[# 5]+0.036*[# 9]+0.036*[# 13] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.036*[# 29]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15] + +0.025*[# 31]+0.025*[# 32] + |psi|^2 = 1.049 +==== e( 11) = 3.13966 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.037*[# 6]+0.037*[# 7] + +0.037*[# 8]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 16]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.037*[# 30]+0.037*[# 31]+0.037*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.963 +==== e( 12) = 3.51483 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.756 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.054*[# 6]+0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31] + +0.054*[# 32]+0.052*[# 10]+0.052*[# 11]+0.052*[# 12]+0.052*[# 18] + +0.052*[# 19]+0.052*[# 20]+0.052*[# 22]+0.052*[# 23]+0.052*[# 24] + +0.052*[# 26]+0.052*[# 27]+0.052*[# 28]+0.050*[# 2]+0.050*[# 3] + +0.050*[# 4]+0.050*[# 7]+0.050*[# 16]+0.050*[# 30] + |psi|^2 = 1.256 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.983 +==== e( 16) = 5.23066 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 6]+0.035*[# 7] + +0.035*[# 8]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 16]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.035*[# 30]+0.035*[# 31]+0.035*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.927 + + k = 0.3333333333 0.8333333333 0.3333333333 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.961 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.015*[# 6]+0.015*[# 8]+0.015*[# 10]+0.015*[# 11] + +0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 18]+0.015*[# 19] + +0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26] + +0.015*[# 27]+0.015*[# 28]+0.015*[# 31]+0.015*[# 32]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.072 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.032*[# 6]+0.032*[# 8]+0.032*[# 14] + +0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.023*[# 10]+0.023*[# 11] + +0.023*[# 12]+0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22] + +0.023*[# 23]+0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.962 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 18]+0.027*[# 19] + +0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26] + +0.027*[# 27]+0.027*[# 28]+0.027*[# 31]+0.027*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 0.953 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.018*[# 7] + +0.018*[# 16]+0.018*[# 30]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.978 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + |psi|^2 = 0.907 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.035*[# 6]+0.035*[# 8] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14]+0.035*[# 15] + +0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23] + +0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 31] + +0.035*[# 32]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30] + |psi|^2 = 0.835 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 + + k = 0.5000000000 0.8333333333 0.3333333333 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 1.108 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.911 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.023*[# 7]+0.023*[# 16] + +0.023*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 1.025 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.025*[# 2] + +0.025*[# 3]+0.025*[# 4]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.013*[# 7] + +0.013*[# 16]+0.013*[# 30] + |psi|^2 = 0.956 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.037*[# 7]+0.037*[# 16]+0.037*[# 30] + +0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.019*[# 1]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.987 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4]+0.013*[# 7] + +0.013*[# 16]+0.013*[# 30] + |psi|^2 = 0.952 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.031*[# 6]+0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31] + +0.031*[# 32]+0.029*[# 1]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.964 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 1.047 +==== e( 12) = 3.70168 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.046*[# 6]+0.046*[# 8] + +0.046*[# 14]+0.046*[# 15]+0.046*[# 31]+0.046*[# 32]+0.038*[# 10] + +0.038*[# 11]+0.038*[# 12]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.028*[# 1]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.010*[# 5]+0.010*[# 13]+0.010*[# 29]+0.007*[# 7] + +0.007*[# 16]+0.007*[# 30] + |psi|^2 = 1.018 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.040*[# 2]+0.040*[# 3] + +0.040*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.002*[# 1] + + |psi|^2 = 1.058 +==== e( 15) = 4.84656 eV ==== + psi = 0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.879 +==== e( 16) = 4.84692 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.041*[# 7]+0.041*[# 16]+0.041*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.947 + + k = 0.6666666667 0.8333333333 0.3333333333 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.961 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.015*[# 6]+0.015*[# 8]+0.015*[# 10]+0.015*[# 11] + +0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 18]+0.015*[# 19] + +0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26] + +0.015*[# 27]+0.015*[# 28]+0.015*[# 31]+0.015*[# 32]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.072 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.032*[# 6]+0.032*[# 8]+0.032*[# 14] + +0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.023*[# 10]+0.023*[# 11] + +0.023*[# 12]+0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22] + +0.023*[# 23]+0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.962 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 18]+0.027*[# 19] + +0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26] + +0.027*[# 27]+0.027*[# 28]+0.027*[# 31]+0.027*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 0.953 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.018*[# 7] + +0.018*[# 16]+0.018*[# 30]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.978 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + |psi|^2 = 0.907 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.035*[# 6]+0.035*[# 8] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14]+0.035*[# 15] + +0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23] + +0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 31] + +0.035*[# 32]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30] + |psi|^2 = 0.835 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 + + k = 0.8333333333 0.8333333333 0.3333333333 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.730 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.025*[# 31]+0.025*[# 32]+0.025*[# 7]+0.025*[# 16] + +0.025*[# 30] + |psi|^2 = 1.271 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 10]+0.014*[# 11] + +0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 18]+0.014*[# 19] + +0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26] + +0.014*[# 27]+0.014*[# 28]+0.014*[# 31]+0.014*[# 32]+0.013*[# 2] + +0.013*[# 3]+0.013*[# 4] + |psi|^2 = 0.990 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.041*[# 7]+0.041*[# 16] + +0.041*[# 30]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 18] + +0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24] + +0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.133 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.742 +==== e( 8) = 2.16363 eV ==== + psi = 0.043*[# 7]+0.043*[# 16]+0.043*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.899 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 7]+0.038*[# 16] + +0.038*[# 30]+0.036*[# 1]+0.036*[# 5]+0.036*[# 9]+0.036*[# 13] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.036*[# 29]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15] + +0.025*[# 31]+0.025*[# 32] + |psi|^2 = 1.049 +==== e( 11) = 3.13966 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.037*[# 6]+0.037*[# 7] + +0.037*[# 8]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 16]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.037*[# 30]+0.037*[# 31]+0.037*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.963 +==== e( 12) = 3.51483 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.756 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.054*[# 6]+0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31] + +0.054*[# 32]+0.052*[# 10]+0.052*[# 11]+0.052*[# 12]+0.052*[# 18] + +0.052*[# 19]+0.052*[# 20]+0.052*[# 22]+0.052*[# 23]+0.052*[# 24] + +0.052*[# 26]+0.052*[# 27]+0.052*[# 28]+0.050*[# 2]+0.050*[# 3] + +0.050*[# 4]+0.050*[# 7]+0.050*[# 16]+0.050*[# 30] + |psi|^2 = 1.256 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.983 +==== e( 16) = 5.23066 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 6]+0.035*[# 7] + +0.035*[# 8]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 16]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.035*[# 30]+0.035*[# 31]+0.035*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.927 + + k = 0.0000000000 0.0000000000 0.5000000000 +==== e( 1) = -4.74394 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4] + +0.022*[# 7]+0.022*[# 16]+0.022*[# 30]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + + |psi|^2 = 0.993 +==== e( 2) = -4.74289 eV ==== + psi = 0.181*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29] + |psi|^2 = 0.725 +==== e( 3) = -1.49898 eV ==== + psi = 0.155*[# 9]+0.155*[# 17]+0.155*[# 21]+0.155*[# 25]+0.054*[# 6] + +0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31]+0.054*[# 32] + +0.031*[# 2]+0.031*[# 3]+0.031*[# 4]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12]+0.011*[# 18] + +0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24] + +0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + |psi|^2 = 1.263 +==== e( 4) = -1.49898 eV ==== + psi = 0.155*[# 9]+0.155*[# 17]+0.155*[# 21]+0.155*[# 25]+0.031*[# 2] + +0.031*[# 3]+0.031*[# 4]+0.031*[# 6]+0.031*[# 7]+0.031*[# 8] + +0.031*[# 14]+0.031*[# 15]+0.031*[# 16]+0.031*[# 30]+0.031*[# 31] + +0.031*[# 32] + |psi|^2 = 0.995 +==== e( 5) = -1.49886 eV ==== + psi = 0.206*[# 5]+0.206*[# 13]+0.206*[# 29]+0.031*[# 10]+0.031*[# 11] + +0.031*[# 12]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22] + +0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + + |psi|^2 = 0.995 +==== e( 6) = -1.49736 eV ==== + psi = 0.310*[# 1]+0.103*[# 5]+0.103*[# 13]+0.103*[# 29]+0.047*[# 10] + +0.047*[# 11]+0.047*[# 12]+0.047*[# 18]+0.047*[# 19]+0.047*[# 20] + +0.047*[# 22]+0.047*[# 23]+0.047*[# 24]+0.047*[# 26]+0.047*[# 27] + +0.047*[# 28] + |psi|^2 = 1.183 +==== e( 7) = 2.25746 eV ==== + psi = 0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 18]+0.051*[# 19] + +0.051*[# 20]+0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26] + +0.051*[# 27]+0.051*[# 28] + |psi|^2 = 0.611 +==== e( 8) = 2.25759 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 16]+0.051*[# 30] + +0.051*[# 31]+0.051*[# 32]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 18]+0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23] + +0.016*[# 24]+0.016*[# 26]+0.016*[# 27]+0.016*[# 28] + |psi|^2 = 0.798 +==== e( 9) = 2.25759 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 16]+0.051*[# 30] + +0.051*[# 31]+0.051*[# 32]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + |psi|^2 = 0.994 +==== e( 10) = 2.25771 eV ==== + psi = 0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 18]+0.051*[# 19] + +0.051*[# 20]+0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26] + +0.051*[# 27]+0.051*[# 28]+0.039*[# 6]+0.039*[# 8]+0.039*[# 14] + +0.039*[# 15]+0.039*[# 31]+0.039*[# 32]+0.012*[# 2]+0.012*[# 3] + +0.012*[# 4]+0.012*[# 7]+0.012*[# 16]+0.012*[# 30] + |psi|^2 = 0.916 +==== e( 11) = 2.64326 eV ==== + psi = 0.110*[# 1]+0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.064*[# 2] + +0.064*[# 3]+0.064*[# 4]+0.055*[# 9]+0.055*[# 17]+0.055*[# 21] + +0.055*[# 25]+0.037*[# 5]+0.037*[# 13]+0.037*[# 29] + |psi|^2 = 0.824 +==== e( 12) = 2.64358 eV ==== + psi = 0.074*[# 5]+0.074*[# 13]+0.074*[# 29]+0.055*[# 9]+0.055*[# 17] + +0.055*[# 21]+0.055*[# 25]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12] + +0.025*[# 18]+0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23] + +0.025*[# 24]+0.025*[# 26]+0.025*[# 27]+0.025*[# 28] + |psi|^2 = 0.747 +==== e( 13) = 4.25697 eV ==== + psi = 0.082*[# 7]+0.082*[# 16]+0.082*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14]+0.041*[# 15] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.041*[# 31] + +0.041*[# 32] + |psi|^2 = 0.990 +==== e( 14) = 4.25697 eV ==== + psi = 0.089*[# 6]+0.089*[# 8]+0.089*[# 14]+0.089*[# 15]+0.089*[# 31] + +0.089*[# 32]+0.082*[# 7]+0.082*[# 16]+0.082*[# 30]+0.059*[# 10] + +0.059*[# 11]+0.059*[# 12]+0.059*[# 18]+0.059*[# 19]+0.059*[# 20] + +0.059*[# 22]+0.059*[# 23]+0.059*[# 24]+0.059*[# 26]+0.059*[# 27] + +0.059*[# 28] + |psi|^2 = 1.490 +==== e( 15) = 4.25808 eV ==== + psi = 0.082*[# 2]+0.082*[# 3]+0.082*[# 4]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14]+0.041*[# 15] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.041*[# 31] + +0.041*[# 32] + |psi|^2 = 0.990 +==== e( 16) = 4.25808 eV ==== + psi = 0.082*[# 2]+0.082*[# 3]+0.082*[# 4]+0.076*[# 6]+0.076*[# 8] + +0.076*[# 14]+0.076*[# 15]+0.076*[# 31]+0.076*[# 32]+0.065*[# 10] + +0.065*[# 11]+0.065*[# 12]+0.065*[# 18]+0.065*[# 19]+0.065*[# 20] + +0.065*[# 22]+0.065*[# 23]+0.065*[# 24]+0.065*[# 26]+0.065*[# 27] + +0.065*[# 28] + |psi|^2 = 1.479 + + k = 0.1666666667 0.0000000000 0.5000000000 +==== e( 1) = -4.63271 eV ==== + psi = 0.120*[# 5]+0.120*[# 13]+0.120*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.001*[# 6]+0.001*[# 8]+0.001*[# 14]+0.001*[# 15]+0.001*[# 31] + +0.001*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.63166 eV ==== + psi = 0.180*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.003*[# 6]+0.003*[# 8] + +0.003*[# 14]+0.003*[# 15]+0.003*[# 31]+0.003*[# 32]+0.002*[# 10] + +0.002*[# 11]+0.002*[# 12]+0.002*[# 18]+0.002*[# 19]+0.002*[# 20] + +0.002*[# 22]+0.002*[# 23]+0.002*[# 24]+0.002*[# 26]+0.002*[# 27] + +0.002*[# 28]+0.002*[# 2]+0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.766 +==== e( 3) = -2.29294 eV ==== + psi = 0.110*[# 5]+0.110*[# 13]+0.110*[# 29]+0.082*[# 9]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.034*[# 6]+0.034*[# 8]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.024*[# 10]+0.024*[# 11] + +0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22] + +0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28] + +0.017*[# 7]+0.017*[# 16]+0.017*[# 30]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4] + |psi|^2 = 1.222 +==== e( 4) = -2.29202 eV ==== + psi = 0.164*[# 1]+0.082*[# 9]+0.082*[# 17]+0.082*[# 21]+0.082*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12]+0.014*[# 18] + +0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24] + +0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.013*[# 6]+0.013*[# 8] + +0.013*[# 14]+0.013*[# 15]+0.013*[# 31]+0.013*[# 32]+0.012*[# 7] + +0.012*[# 16]+0.012*[# 30] + |psi|^2 = 0.995 +==== e( 5) = -0.76680 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19] + +0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26] + +0.018*[# 27]+0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.994 +==== e( 6) = -0.76629 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30]+0.014*[# 2] + +0.014*[# 3]+0.014*[# 4] + |psi|^2 = 1.135 +==== e( 7) = 1.89706 eV ==== + psi = 0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.028*[# 10] + +0.028*[# 11]+0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.003*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.674 +==== e( 8) = 1.89734 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.034*[# 7]+0.034*[# 16] + +0.034*[# 30]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 18] + +0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24] + +0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.815 +==== e( 9) = 2.23554 eV ==== + psi = 0.103*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15]+0.040*[# 31] + +0.040*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.987 +==== e( 10) = 2.23572 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.016*[# 2]+0.016*[# 3]+0.016*[# 4] + +0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15]+0.008*[# 31] + +0.008*[# 32] + |psi|^2 = 0.680 +==== e( 11) = 3.04468 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.048*[# 2]+0.048*[# 3] + +0.048*[# 4]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.971 +==== e( 12) = 3.04476 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20] + +0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27] + +0.027*[# 28]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.002*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.664 +==== e( 13) = 3.80535 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.989 +==== e( 14) = 3.80571 eV ==== + psi = 0.072*[# 2]+0.072*[# 3]+0.072*[# 4]+0.053*[# 7]+0.053*[# 16] + +0.053*[# 30]+0.049*[# 10]+0.049*[# 11]+0.049*[# 12]+0.049*[# 18] + +0.049*[# 19]+0.049*[# 20]+0.049*[# 22]+0.049*[# 23]+0.049*[# 24] + +0.049*[# 26]+0.049*[# 27]+0.049*[# 28]+0.036*[# 6]+0.036*[# 8] + +0.036*[# 14]+0.036*[# 15]+0.036*[# 31]+0.036*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 1.231 +==== e( 15) = 4.52337 eV ==== + psi = 0.050*[# 7]+0.050*[# 16]+0.050*[# 30]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.871 +==== e( 16) = 4.52360 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.045*[# 10]+0.045*[# 11]+0.045*[# 12]+0.045*[# 18] + +0.045*[# 19]+0.045*[# 20]+0.045*[# 22]+0.045*[# 23]+0.045*[# 24] + +0.045*[# 26]+0.045*[# 27]+0.045*[# 28]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30]+0.006*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 1.113 + + k = 0.3333333333 0.0000000000 0.5000000000 +==== e( 1) = -4.30426 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.30321 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 14]+0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 18]+0.007*[# 19]+0.007*[# 20] + +0.007*[# 22]+0.007*[# 23]+0.007*[# 24]+0.007*[# 26]+0.007*[# 27] + +0.007*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.001*[# 7] + +0.001*[# 16]+0.001*[# 30] + |psi|^2 = 0.870 +==== e( 3) = -3.08338 eV ==== + psi = 0.113*[# 5]+0.113*[# 13]+0.113*[# 29]+0.084*[# 9]+0.084*[# 17] + +0.084*[# 21]+0.084*[# 25]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14] + +0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.019*[# 10]+0.019*[# 11] + +0.019*[# 12]+0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22] + +0.019*[# 23]+0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28] + +0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.005*[# 2]+0.005*[# 3] + +0.005*[# 4] + |psi|^2 = 1.121 +==== e( 4) = -3.08238 eV ==== + psi = 0.169*[# 1]+0.084*[# 9]+0.084*[# 17]+0.084*[# 21]+0.084*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18] + +0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24] + +0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.997 +==== e( 5) = -0.06735 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.060*[# 9]+0.060*[# 17] + +0.060*[# 21]+0.060*[# 25]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + +0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19] + +0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26] + +0.021*[# 27]+0.021*[# 28]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 16]+0.018*[# 30]+0.018*[# 31] + +0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.06705 eV ==== + psi = 0.121*[# 1]+0.060*[# 9]+0.060*[# 17]+0.060*[# 21]+0.060*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.024*[# 7] + +0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 16]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30]+0.012*[# 2] + +0.012*[# 3]+0.012*[# 4] + |psi|^2 = 1.067 +==== e( 7) = 1.46284 eV ==== + psi = 0.102*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.019*[# 7] + +0.019*[# 16]+0.019*[# 30]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.011*[# 2] + +0.011*[# 3]+0.011*[# 4] + |psi|^2 = 0.832 +==== e( 8) = 1.46285 eV ==== + psi = 0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.023*[# 7]+0.023*[# 16]+0.023*[# 30]+0.021*[# 10]+0.021*[# 11] + +0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22] + +0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28] + +0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15]+0.015*[# 31] + +0.015*[# 32] + |psi|^2 = 0.905 +==== e( 9) = 1.95717 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 1.95751 eV ==== + psi = 0.056*[# 2]+0.056*[# 3]+0.056*[# 4]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.036*[# 7]+0.036*[# 16]+0.036*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.928 +==== e( 11) = 3.02286 eV ==== + psi = 0.065*[# 7]+0.065*[# 16]+0.065*[# 30]+0.045*[# 2]+0.045*[# 3] + +0.045*[# 4]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.020*[# 1] + +0.010*[# 9]+0.010*[# 17]+0.010*[# 21]+0.010*[# 25]+0.007*[# 5] + +0.007*[# 13]+0.007*[# 29] + |psi|^2 = 1.115 +==== e( 12) = 3.02323 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.042*[# 2]+0.042*[# 3]+0.042*[# 4]+0.040*[# 10] + +0.040*[# 11]+0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30]+0.013*[# 5] + +0.013*[# 13]+0.013*[# 29]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25] + |psi|^2 = 1.051 +==== e( 13) = 4.06622 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 4.06644 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.038*[# 2]+0.038*[# 3] + +0.038*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 1.001 +==== e( 15) = 4.88257 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.040*[# 7]+0.040*[# 16] + +0.040*[# 30]+0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 1.023 +==== e( 16) = 4.88277 eV ==== + psi = 0.078*[# 2]+0.078*[# 3]+0.078*[# 4]+0.045*[# 7]+0.045*[# 16] + +0.045*[# 30]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.034 + + k = 0.5000000000 0.0000000000 0.5000000000 +==== e( 1) = -3.77594 eV ==== + psi = 0.115*[# 5]+0.115*[# 13]+0.115*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.045*[# 7]+0.045*[# 16]+0.045*[# 30] + +0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19] + +0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26] + +0.013*[# 27]+0.013*[# 28]+0.005*[# 2]+0.005*[# 3]+0.005*[# 4] + + |psi|^2 = 0.994 +==== e( 2) = -3.77569 eV ==== + psi = 0.115*[# 5]+0.115*[# 13]+0.115*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.024*[# 6]+0.024*[# 8]+0.024*[# 14] + +0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.013*[# 10]+0.013*[# 11] + +0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22] + +0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28] + +0.003*[# 2]+0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.994 +==== e( 3) = -3.77569 eV ==== + psi = 0.115*[# 5]+0.115*[# 13]+0.115*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.039*[# 2]+0.039*[# 3]+0.039*[# 4] + +0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19] + +0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26] + +0.013*[# 27]+0.013*[# 28]+0.006*[# 6]+0.006*[# 8]+0.006*[# 14] + +0.006*[# 15]+0.006*[# 31]+0.006*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -3.77387 eV ==== + psi = 0.345*[# 1]+0.086*[# 9]+0.086*[# 17]+0.086*[# 21]+0.086*[# 25] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18] + +0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24] + +0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.005*[# 7]+0.005*[# 16] + +0.005*[# 30]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.994 +==== e( 5) = 0.66844 eV ==== + psi = 0.072*[# 5]+0.072*[# 13]+0.072*[# 29]+0.054*[# 9]+0.054*[# 17] + +0.054*[# 21]+0.054*[# 25]+0.035*[# 6]+0.035*[# 8]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 31]+0.035*[# 32]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 18] + +0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23]+0.023*[# 24] + +0.023*[# 26]+0.023*[# 27]+0.023*[# 28] + |psi|^2 = 0.992 +==== e( 6) = 0.66844 eV ==== + psi = 0.072*[# 5]+0.072*[# 13]+0.072*[# 29]+0.054*[# 9]+0.054*[# 17] + +0.054*[# 21]+0.054*[# 25]+0.035*[# 6]+0.035*[# 8]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 31]+0.035*[# 32]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 18] + +0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23]+0.023*[# 24] + +0.023*[# 26]+0.023*[# 27]+0.023*[# 28] + |psi|^2 = 0.992 +==== e( 7) = 0.66848 eV ==== + psi = 0.072*[# 5]+0.072*[# 13]+0.072*[# 29]+0.067*[# 2]+0.067*[# 3] + +0.067*[# 4]+0.054*[# 9]+0.054*[# 17]+0.054*[# 21]+0.054*[# 25] + +0.023*[# 7]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 16] + +0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23] + +0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.023*[# 30] + +0.001*[# 6]+0.001*[# 8]+0.001*[# 14]+0.001*[# 15]+0.001*[# 31] + +0.001*[# 32] + |psi|^2 = 0.992 +==== e( 8) = 0.66874 eV ==== + psi = 0.217*[# 1]+0.054*[# 9]+0.054*[# 17]+0.054*[# 21]+0.054*[# 25] + +0.047*[# 7]+0.047*[# 16]+0.047*[# 30]+0.023*[# 10]+0.023*[# 11] + +0.023*[# 12]+0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22] + +0.023*[# 23]+0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28] + +0.022*[# 6]+0.022*[# 8]+0.022*[# 14]+0.022*[# 15]+0.022*[# 31] + +0.022*[# 32]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.992 +==== e( 9) = 2.36032 eV ==== + psi = 0.080*[# 7]+0.080*[# 16]+0.080*[# 30]+0.038*[# 10]+0.038*[# 11] + +0.038*[# 12]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20]+0.038*[# 22] + +0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27]+0.038*[# 28] + +0.037*[# 1]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 31]+0.037*[# 32]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.991 +==== e( 10) = 2.36083 eV ==== + psi = 0.054*[# 6]+0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31] + +0.054*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.012*[# 5]+0.012*[# 13]+0.012*[# 29]+0.009*[# 9] + +0.009*[# 17]+0.009*[# 21]+0.009*[# 25]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 0.991 +==== e( 11) = 2.36083 eV ==== + psi = 0.056*[# 2]+0.056*[# 3]+0.056*[# 4]+0.048*[# 6]+0.048*[# 8] + +0.048*[# 14]+0.048*[# 15]+0.048*[# 31]+0.048*[# 32]+0.038*[# 10] + +0.038*[# 11]+0.038*[# 12]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.012*[# 5]+0.012*[# 13]+0.012*[# 29]+0.009*[# 9] + +0.009*[# 17]+0.009*[# 21]+0.009*[# 25] + |psi|^2 = 0.991 +==== e( 12) = 2.36105 eV ==== + psi = 0.088*[# 2]+0.088*[# 3]+0.088*[# 4]+0.038*[# 10]+0.038*[# 11] + +0.038*[# 12]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20]+0.038*[# 22] + +0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27]+0.038*[# 28] + +0.037*[# 7]+0.037*[# 16]+0.037*[# 30]+0.014*[# 6]+0.014*[# 8] + +0.014*[# 14]+0.014*[# 15]+0.014*[# 31]+0.014*[# 32]+0.012*[# 5] + +0.012*[# 13]+0.012*[# 29]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.991 +==== e( 13) = 4.82921 eV ==== + psi = 0.165*[# 7]+0.165*[# 16]+0.165*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.989 +==== e( 14) = 4.82971 eV ==== + psi = 0.082*[# 6]+0.082*[# 8]+0.082*[# 14]+0.082*[# 15]+0.082*[# 31] + +0.082*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + |psi|^2 = 0.988 +==== e( 15) = 4.83052 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 14]+0.050*[# 15]+0.050*[# 31]+0.050*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28] + |psi|^2 = 0.989 +==== e( 16) = 4.83052 eV ==== + psi = 0.082*[# 7]+0.082*[# 16]+0.082*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.033*[# 6]+0.033*[# 8]+0.033*[# 14]+0.033*[# 15]+0.033*[# 31] + +0.033*[# 32]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + |psi|^2 = 0.988 + + k = 0.6666666667 0.0000000000 0.5000000000 +==== e( 1) = -4.30426 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.30321 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 14]+0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 18]+0.007*[# 19]+0.007*[# 20] + +0.007*[# 22]+0.007*[# 23]+0.007*[# 24]+0.007*[# 26]+0.007*[# 27] + +0.007*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.001*[# 7] + +0.001*[# 16]+0.001*[# 30] + |psi|^2 = 0.870 +==== e( 3) = -3.08338 eV ==== + psi = 0.113*[# 5]+0.113*[# 13]+0.113*[# 29]+0.084*[# 9]+0.084*[# 17] + +0.084*[# 21]+0.084*[# 25]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14] + +0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.019*[# 10]+0.019*[# 11] + +0.019*[# 12]+0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22] + +0.019*[# 23]+0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28] + +0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.005*[# 2]+0.005*[# 3] + +0.005*[# 4] + |psi|^2 = 1.121 +==== e( 4) = -3.08238 eV ==== + psi = 0.169*[# 1]+0.084*[# 9]+0.084*[# 17]+0.084*[# 21]+0.084*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18] + +0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24] + +0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.997 +==== e( 5) = -0.06735 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.060*[# 9]+0.060*[# 17] + +0.060*[# 21]+0.060*[# 25]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + +0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19] + +0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26] + +0.021*[# 27]+0.021*[# 28]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 16]+0.018*[# 30]+0.018*[# 31] + +0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.06705 eV ==== + psi = 0.121*[# 1]+0.060*[# 9]+0.060*[# 17]+0.060*[# 21]+0.060*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.024*[# 7] + +0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 16]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30]+0.012*[# 2] + +0.012*[# 3]+0.012*[# 4] + |psi|^2 = 1.067 +==== e( 7) = 1.46284 eV ==== + psi = 0.102*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.019*[# 7] + +0.019*[# 16]+0.019*[# 30]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.011*[# 2] + +0.011*[# 3]+0.011*[# 4] + |psi|^2 = 0.832 +==== e( 8) = 1.46285 eV ==== + psi = 0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.023*[# 7]+0.023*[# 16]+0.023*[# 30]+0.021*[# 10]+0.021*[# 11] + +0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22] + +0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28] + +0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15]+0.015*[# 31] + +0.015*[# 32] + |psi|^2 = 0.905 +==== e( 9) = 1.95717 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 1.95751 eV ==== + psi = 0.056*[# 2]+0.056*[# 3]+0.056*[# 4]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.036*[# 7]+0.036*[# 16]+0.036*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.928 +==== e( 11) = 3.02286 eV ==== + psi = 0.065*[# 7]+0.065*[# 16]+0.065*[# 30]+0.045*[# 2]+0.045*[# 3] + +0.045*[# 4]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.020*[# 1] + +0.010*[# 9]+0.010*[# 17]+0.010*[# 21]+0.010*[# 25]+0.007*[# 5] + +0.007*[# 13]+0.007*[# 29] + |psi|^2 = 1.115 +==== e( 12) = 3.02323 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.042*[# 2]+0.042*[# 3]+0.042*[# 4]+0.040*[# 10] + +0.040*[# 11]+0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30]+0.013*[# 5] + +0.013*[# 13]+0.013*[# 29]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25] + |psi|^2 = 1.051 +==== e( 13) = 4.06622 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 4.06644 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.038*[# 2]+0.038*[# 3] + +0.038*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 1.001 +==== e( 15) = 4.88257 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.040*[# 7]+0.040*[# 16] + +0.040*[# 30]+0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 1.023 +==== e( 16) = 4.88277 eV ==== + psi = 0.078*[# 2]+0.078*[# 3]+0.078*[# 4]+0.045*[# 7]+0.045*[# 16] + +0.045*[# 30]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.034 + + k = 0.8333333333 0.0000000000 0.5000000000 +==== e( 1) = -4.63271 eV ==== + psi = 0.120*[# 5]+0.120*[# 13]+0.120*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.001*[# 6]+0.001*[# 8]+0.001*[# 14]+0.001*[# 15]+0.001*[# 31] + +0.001*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.63166 eV ==== + psi = 0.180*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.003*[# 6]+0.003*[# 8] + +0.003*[# 14]+0.003*[# 15]+0.003*[# 31]+0.003*[# 32]+0.002*[# 10] + +0.002*[# 11]+0.002*[# 12]+0.002*[# 18]+0.002*[# 19]+0.002*[# 20] + +0.002*[# 22]+0.002*[# 23]+0.002*[# 24]+0.002*[# 26]+0.002*[# 27] + +0.002*[# 28]+0.002*[# 2]+0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.766 +==== e( 3) = -2.29294 eV ==== + psi = 0.110*[# 5]+0.110*[# 13]+0.110*[# 29]+0.082*[# 9]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.034*[# 6]+0.034*[# 8]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.024*[# 10]+0.024*[# 11] + +0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22] + +0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28] + +0.017*[# 7]+0.017*[# 16]+0.017*[# 30]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4] + |psi|^2 = 1.222 +==== e( 4) = -2.29202 eV ==== + psi = 0.164*[# 1]+0.082*[# 9]+0.082*[# 17]+0.082*[# 21]+0.082*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12]+0.014*[# 18] + +0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24] + +0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.013*[# 6]+0.013*[# 8] + +0.013*[# 14]+0.013*[# 15]+0.013*[# 31]+0.013*[# 32]+0.012*[# 7] + +0.012*[# 16]+0.012*[# 30] + |psi|^2 = 0.995 +==== e( 5) = -0.76680 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19] + +0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26] + +0.018*[# 27]+0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.994 +==== e( 6) = -0.76629 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30]+0.014*[# 2] + +0.014*[# 3]+0.014*[# 4] + |psi|^2 = 1.135 +==== e( 7) = 1.89706 eV ==== + psi = 0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.028*[# 10] + +0.028*[# 11]+0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.003*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.674 +==== e( 8) = 1.89734 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.034*[# 7]+0.034*[# 16] + +0.034*[# 30]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 18] + +0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24] + +0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.815 +==== e( 9) = 2.23554 eV ==== + psi = 0.103*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15]+0.040*[# 31] + +0.040*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.987 +==== e( 10) = 2.23572 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.016*[# 2]+0.016*[# 3]+0.016*[# 4] + +0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15]+0.008*[# 31] + +0.008*[# 32] + |psi|^2 = 0.680 +==== e( 11) = 3.04468 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.048*[# 2]+0.048*[# 3] + +0.048*[# 4]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.971 +==== e( 12) = 3.04476 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20] + +0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27] + +0.027*[# 28]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.002*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.664 +==== e( 13) = 3.80535 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.989 +==== e( 14) = 3.80571 eV ==== + psi = 0.072*[# 2]+0.072*[# 3]+0.072*[# 4]+0.053*[# 7]+0.053*[# 16] + +0.053*[# 30]+0.049*[# 10]+0.049*[# 11]+0.049*[# 12]+0.049*[# 18] + +0.049*[# 19]+0.049*[# 20]+0.049*[# 22]+0.049*[# 23]+0.049*[# 24] + +0.049*[# 26]+0.049*[# 27]+0.049*[# 28]+0.036*[# 6]+0.036*[# 8] + +0.036*[# 14]+0.036*[# 15]+0.036*[# 31]+0.036*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 1.231 +==== e( 15) = 4.52337 eV ==== + psi = 0.050*[# 7]+0.050*[# 16]+0.050*[# 30]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.871 +==== e( 16) = 4.52360 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.045*[# 10]+0.045*[# 11]+0.045*[# 12]+0.045*[# 18] + +0.045*[# 19]+0.045*[# 20]+0.045*[# 22]+0.045*[# 23]+0.045*[# 24] + +0.045*[# 26]+0.045*[# 27]+0.045*[# 28]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30]+0.006*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 1.113 + + k = 0.0000000000 0.1666666667 0.5000000000 +==== e( 1) = -4.63271 eV ==== + psi = 0.120*[# 5]+0.120*[# 13]+0.120*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.001*[# 6]+0.001*[# 8]+0.001*[# 14]+0.001*[# 15]+0.001*[# 31] + +0.001*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.63166 eV ==== + psi = 0.180*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.001*[# 10]+0.001*[# 11]+0.001*[# 12]+0.001*[# 18] + +0.001*[# 19]+0.001*[# 20]+0.001*[# 22]+0.001*[# 23]+0.001*[# 24] + +0.001*[# 26]+0.001*[# 27]+0.001*[# 28]+0.001*[# 6]+0.001*[# 8] + +0.001*[# 14]+0.001*[# 15]+0.001*[# 31]+0.001*[# 32] + |psi|^2 = 0.748 +==== e( 3) = -2.29294 eV ==== + psi = 0.110*[# 5]+0.110*[# 13]+0.110*[# 29]+0.082*[# 9]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.034*[# 6]+0.034*[# 8]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.024*[# 10]+0.024*[# 11] + +0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22] + +0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28] + +0.017*[# 7]+0.017*[# 16]+0.017*[# 30]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4] + |psi|^2 = 1.222 +==== e( 4) = -2.29202 eV ==== + psi = 0.164*[# 1]+0.082*[# 9]+0.082*[# 17]+0.082*[# 21]+0.082*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.017*[# 2]+0.017*[# 3] + +0.017*[# 4]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.010*[# 7] + +0.010*[# 16]+0.010*[# 30] + |psi|^2 = 0.977 +==== e( 5) = -0.76680 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19] + +0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26] + +0.018*[# 27]+0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.994 +==== e( 6) = -0.76629 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.043*[# 7]+0.043*[# 16] + +0.043*[# 30]+0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.028*[# 10] + +0.028*[# 11]+0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32] + |psi|^2 = 1.229 +==== e( 7) = 1.89706 eV ==== + psi = 0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.028*[# 10] + +0.028*[# 11]+0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.003*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.674 +==== e( 8) = 1.89734 eV ==== + psi = 0.048*[# 6]+0.048*[# 8]+0.048*[# 14]+0.048*[# 15]+0.048*[# 31] + +0.048*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.909 +==== e( 9) = 2.23554 eV ==== + psi = 0.103*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15]+0.040*[# 31] + +0.040*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.987 +==== e( 10) = 2.23572 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.013*[# 10]+0.013*[# 11] + +0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22] + +0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28] + +0.010*[# 2]+0.010*[# 3]+0.010*[# 4]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.717 +==== e( 11) = 3.04468 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.048*[# 2]+0.048*[# 3] + +0.048*[# 4]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.971 +==== e( 12) = 3.04476 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.026*[# 7]+0.026*[# 16]+0.026*[# 30]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.002*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.701 +==== e( 13) = 3.80535 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.989 +==== e( 14) = 3.80571 eV ==== + psi = 0.082*[# 6]+0.082*[# 8]+0.082*[# 14]+0.082*[# 15]+0.082*[# 31] + +0.082*[# 32]+0.059*[# 10]+0.059*[# 11]+0.059*[# 12]+0.059*[# 18] + +0.059*[# 19]+0.059*[# 20]+0.059*[# 22]+0.059*[# 23]+0.059*[# 24] + +0.059*[# 26]+0.059*[# 27]+0.059*[# 28]+0.046*[# 2]+0.046*[# 3] + +0.046*[# 4]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 1.459 +==== e( 15) = 4.52337 eV ==== + psi = 0.050*[# 7]+0.050*[# 16]+0.050*[# 30]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.871 +==== e( 16) = 4.52360 eV ==== + psi = 0.089*[# 2]+0.089*[# 3]+0.089*[# 4]+0.066*[# 7]+0.066*[# 16] + +0.066*[# 30]+0.055*[# 10]+0.055*[# 11]+0.055*[# 12]+0.055*[# 18] + +0.055*[# 19]+0.055*[# 20]+0.055*[# 22]+0.055*[# 23]+0.055*[# 24] + +0.055*[# 26]+0.055*[# 27]+0.055*[# 28]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.006*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 1.340 + + k = 0.1666666667 0.1666666667 0.5000000000 +==== e( 1) = -4.52498 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.52394 eV ==== + psi = 0.179*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 8]+0.003*[# 14]+0.003*[# 15] + +0.003*[# 31]+0.003*[# 32]+0.003*[# 10]+0.003*[# 11]+0.003*[# 12] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28] + |psi|^2 = 0.785 +==== e( 3) = -2.53521 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.031*[# 6]+0.031*[# 8]+0.031*[# 14] + +0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22] + +0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + +0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 1.203 +==== e( 4) = -2.53429 eV ==== + psi = 0.172*[# 1]+0.086*[# 9]+0.086*[# 17]+0.086*[# 21]+0.086*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.013*[# 7]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 16]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22] + +0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28] + +0.013*[# 30]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.995 +==== e( 5) = -0.69955 eV ==== + psi = 0.078*[# 5]+0.078*[# 13]+0.078*[# 29]+0.059*[# 9]+0.059*[# 17] + +0.059*[# 21]+0.059*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.69934 eV ==== + psi = 0.117*[# 1]+0.059*[# 9]+0.059*[# 17]+0.059*[# 21]+0.059*[# 25] + +0.047*[# 7]+0.047*[# 16]+0.047*[# 30]+0.039*[# 5]+0.039*[# 13] + +0.039*[# 29]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.129 +==== e( 7) = 1.70960 eV ==== + psi = 0.051*[# 5]+0.051*[# 13]+0.051*[# 29]+0.046*[# 9]+0.046*[# 17] + +0.046*[# 21]+0.046*[# 25]+0.036*[# 7]+0.036*[# 16]+0.036*[# 30] + +0.029*[# 1]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18] + +0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24] + +0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.014*[# 6]+0.014*[# 8] + +0.014*[# 14]+0.014*[# 15]+0.014*[# 31]+0.014*[# 32]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.796 +==== e( 8) = 1.71009 eV ==== + psi = 0.062*[# 1]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.030*[# 6]+0.030*[# 8]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 31]+0.030*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 0.933 +==== e( 9) = 2.10371 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.10436 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 6]+0.049*[# 8] + +0.049*[# 14]+0.049*[# 15]+0.049*[# 31]+0.049*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.017*[# 1]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + +0.009*[# 9]+0.009*[# 17]+0.009*[# 21]+0.009*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 1.048 +==== e( 11) = 3.36740 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.039*[# 7]+0.039*[# 16] + +0.039*[# 30]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 18] + +0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23]+0.034*[# 24] + +0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32] + |psi|^2 = 0.828 +==== e( 12) = 3.36742 eV ==== + psi = 0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.039*[# 2]+0.039*[# 3] + +0.039*[# 4]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.883 +==== e( 13) = 4.14946 eV ==== + psi = 0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.028*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.988 +==== e( 14) = 4.14988 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 8] + +0.038*[# 14]+0.038*[# 15]+0.038*[# 31]+0.038*[# 32]+0.029*[# 10] + +0.029*[# 11]+0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.002*[# 1]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.820 +==== e( 15) = 4.40345 eV ==== + psi = 0.110*[# 7]+0.110*[# 16]+0.110*[# 30]+0.058*[# 10]+0.058*[# 11] + +0.058*[# 12]+0.058*[# 18]+0.058*[# 19]+0.058*[# 20]+0.058*[# 22] + +0.058*[# 23]+0.058*[# 24]+0.058*[# 26]+0.058*[# 27]+0.058*[# 28] + +0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + |psi|^2 = 1.390 +==== e( 16) = 4.40456 eV ==== + psi = 0.101*[# 2]+0.101*[# 3]+0.101*[# 4]+0.051*[# 10]+0.051*[# 11] + +0.051*[# 12]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20]+0.051*[# 22] + +0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27]+0.051*[# 28] + +0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30] + |psi|^2 = 1.223 + + k = 0.3333333333 0.1666666667 0.5000000000 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.009*[# 6]+0.009*[# 8] + +0.009*[# 14]+0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 18]+0.007*[# 19]+0.007*[# 20] + +0.007*[# 22]+0.007*[# 23]+0.007*[# 24]+0.007*[# 26]+0.007*[# 27] + +0.007*[# 28]+0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.880 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14] + +0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.017*[# 10]+0.017*[# 11] + +0.017*[# 12]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20]+0.017*[# 22] + +0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27]+0.017*[# 28] + +0.012*[# 7]+0.012*[# 16]+0.012*[# 30]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 1.118 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.017*[# 2]+0.017*[# 3] + +0.017*[# 4]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 1.004 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.028*[# 2] + +0.028*[# 3]+0.028*[# 4]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.026 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.036*[# 7]+0.036*[# 16]+0.036*[# 30] + +0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.019*[# 1]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.930 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.044*[# 9] + +0.044*[# 17]+0.044*[# 21]+0.044*[# 25]+0.035*[# 5]+0.035*[# 13] + +0.035*[# 29]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 18] + +0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24] + +0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.016*[# 7] + +0.016*[# 16]+0.016*[# 30] + |psi|^2 = 0.965 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.038*[# 10] + +0.038*[# 11]+0.038*[# 12]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.029*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 1.021 +==== e( 11) = 3.70118 eV ==== + psi = 0.057*[# 7]+0.057*[# 16]+0.057*[# 30]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.031*[# 6]+0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31] + +0.031*[# 32]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.967 +==== e( 12) = 3.70168 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.028*[# 1]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30] + +0.014*[# 9]+0.014*[# 17]+0.014*[# 21]+0.014*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.995 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.989 +==== e( 14) = 4.17314 eV ==== + psi = 0.054*[# 6]+0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31] + +0.054*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.002*[# 1] + + |psi|^2 = 0.921 +==== e( 15) = 4.84656 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.012*[# 2]+0.012*[# 3]+0.012*[# 4]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 1.118 +==== e( 16) = 4.84692 eV ==== + psi = 0.078*[# 2]+0.078*[# 3]+0.078*[# 4]+0.043*[# 10]+0.043*[# 11] + +0.043*[# 12]+0.043*[# 18]+0.043*[# 19]+0.043*[# 20]+0.043*[# 22] + +0.043*[# 23]+0.043*[# 24]+0.043*[# 26]+0.043*[# 27]+0.043*[# 28] + +0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.050 + + k = 0.5000000000 0.1666666667 0.5000000000 +==== e( 1) = -3.71242 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19] + +0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26] + +0.012*[# 27]+0.012*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.71222 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15]+0.015*[# 31] + +0.015*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.002*[# 7]+0.002*[# 16] + +0.002*[# 30] + |psi|^2 = 0.994 +==== e( 3) = -3.71222 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14] + +0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.010*[# 2]+0.010*[# 3]+0.010*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -3.71037 eV ==== + psi = 0.353*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.012*[# 6]+0.012*[# 8] + +0.012*[# 14]+0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.008*[# 7]+0.008*[# 16]+0.008*[# 30] + |psi|^2 = 0.994 +==== e( 5) = 0.12722 eV ==== + psi = 0.098*[# 7]+0.098*[# 16]+0.098*[# 30]+0.045*[# 5]+0.045*[# 13] + +0.045*[# 29]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.041*[# 1]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 0.991 +==== e( 6) = 0.12772 eV ==== + psi = 0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.049*[# 6]+0.049*[# 8] + +0.049*[# 14]+0.049*[# 15]+0.049*[# 31]+0.049*[# 32]+0.044*[# 9] + +0.044*[# 17]+0.044*[# 21]+0.044*[# 25]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.008*[# 2]+0.008*[# 3]+0.008*[# 4] + |psi|^2 = 0.991 +==== e( 7) = 0.12772 eV ==== + psi = 0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.042*[# 2]+0.042*[# 3]+0.042*[# 4] + +0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + |psi|^2 = 0.991 +==== e( 8) = 0.12828 eV ==== + psi = 0.135*[# 1]+0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.044*[# 9] + +0.044*[# 17]+0.044*[# 21]+0.044*[# 25]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.014*[# 5]+0.014*[# 13]+0.014*[# 29]+0.008*[# 7] + +0.008*[# 16]+0.008*[# 30] + |psi|^2 = 0.991 +==== e( 9) = 3.08095 eV ==== + psi = 0.122*[# 7]+0.122*[# 16]+0.122*[# 30]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.020*[# 5]+0.020*[# 13]+0.020*[# 29]+0.016*[# 9]+0.016*[# 17] + +0.016*[# 21]+0.016*[# 25]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14] + +0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.001*[# 1] + |psi|^2 = 0.991 +==== e( 10) = 3.08168 eV ==== + psi = 0.067*[# 6]+0.067*[# 8]+0.067*[# 14]+0.067*[# 15]+0.067*[# 31] + +0.067*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.021*[# 5]+0.021*[# 13] + +0.021*[# 29]+0.016*[# 9]+0.016*[# 17]+0.016*[# 21]+0.016*[# 25] + +0.010*[# 7]+0.010*[# 16]+0.010*[# 30] + |psi|^2 = 0.991 +==== e( 11) = 3.08168 eV ==== + psi = 0.063*[# 2]+0.063*[# 3]+0.063*[# 4]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.021*[# 5]+0.021*[# 13]+0.021*[# 29]+0.016*[# 9] + +0.016*[# 17]+0.016*[# 21]+0.016*[# 25] + |psi|^2 = 0.991 +==== e( 12) = 3.08237 eV ==== + psi = 0.078*[# 2]+0.078*[# 3]+0.078*[# 4]+0.061*[# 1]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 31]+0.027*[# 32]+0.016*[# 9]+0.016*[# 17]+0.016*[# 21] + +0.016*[# 25]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30] + |psi|^2 = 0.991 +==== e( 13) = 4.86024 eV ==== + psi = 0.164*[# 7]+0.164*[# 16]+0.164*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.988 +==== e( 14) = 4.86071 eV ==== + psi = 0.082*[# 6]+0.082*[# 8]+0.082*[# 14]+0.082*[# 15]+0.082*[# 31] + +0.082*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + |psi|^2 = 0.988 +==== e( 15) = 4.86155 eV ==== + psi = 0.073*[# 6]+0.073*[# 8]+0.073*[# 14]+0.073*[# 15]+0.073*[# 31] + +0.073*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4] + |psi|^2 = 0.988 +==== e( 16) = 4.86155 eV ==== + psi = 0.082*[# 7]+0.082*[# 16]+0.082*[# 30]+0.064*[# 2]+0.064*[# 3] + +0.064*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.009*[# 6]+0.009*[# 8] + +0.009*[# 14]+0.009*[# 15]+0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.989 + + k = 0.6666666667 0.1666666667 0.5000000000 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.009*[# 6]+0.009*[# 8] + +0.009*[# 14]+0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 18]+0.007*[# 19]+0.007*[# 20] + +0.007*[# 22]+0.007*[# 23]+0.007*[# 24]+0.007*[# 26]+0.007*[# 27] + +0.007*[# 28]+0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.880 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14] + +0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.017*[# 10]+0.017*[# 11] + +0.017*[# 12]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20]+0.017*[# 22] + +0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27]+0.017*[# 28] + +0.012*[# 7]+0.012*[# 16]+0.012*[# 30]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 1.118 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.017*[# 2]+0.017*[# 3] + +0.017*[# 4]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 1.004 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.028*[# 2] + +0.028*[# 3]+0.028*[# 4]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.026 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.036*[# 7]+0.036*[# 16]+0.036*[# 30] + +0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.019*[# 1]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.930 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.044*[# 9] + +0.044*[# 17]+0.044*[# 21]+0.044*[# 25]+0.035*[# 5]+0.035*[# 13] + +0.035*[# 29]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 18] + +0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24] + +0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.016*[# 7] + +0.016*[# 16]+0.016*[# 30] + |psi|^2 = 0.965 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.038*[# 10] + +0.038*[# 11]+0.038*[# 12]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.029*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 1.021 +==== e( 11) = 3.70118 eV ==== + psi = 0.057*[# 7]+0.057*[# 16]+0.057*[# 30]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.031*[# 6]+0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31] + +0.031*[# 32]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.967 +==== e( 12) = 3.70168 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.028*[# 1]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30] + +0.014*[# 9]+0.014*[# 17]+0.014*[# 21]+0.014*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.995 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.054*[# 6]+0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31] + +0.054*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.002*[# 1] + + |psi|^2 = 0.921 +==== e( 15) = 4.84656 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.012*[# 2]+0.012*[# 3]+0.012*[# 4]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 1.118 +==== e( 16) = 4.84692 eV ==== + psi = 0.078*[# 2]+0.078*[# 3]+0.078*[# 4]+0.043*[# 10]+0.043*[# 11] + +0.043*[# 12]+0.043*[# 18]+0.043*[# 19]+0.043*[# 20]+0.043*[# 22] + +0.043*[# 23]+0.043*[# 24]+0.043*[# 26]+0.043*[# 27]+0.043*[# 28] + +0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.050 + + k = 0.8333333333 0.1666666667 0.5000000000 +==== e( 1) = -4.52498 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.52394 eV ==== + psi = 0.179*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 8]+0.003*[# 14]+0.003*[# 15] + +0.003*[# 31]+0.003*[# 32]+0.003*[# 10]+0.003*[# 11]+0.003*[# 12] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28] + |psi|^2 = 0.785 +==== e( 3) = -2.53521 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.031*[# 6]+0.031*[# 8]+0.031*[# 14] + +0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22] + +0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + +0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 1.203 +==== e( 4) = -2.53429 eV ==== + psi = 0.172*[# 1]+0.086*[# 9]+0.086*[# 17]+0.086*[# 21]+0.086*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.013*[# 7]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 16]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22] + +0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28] + +0.013*[# 30]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.995 +==== e( 5) = -0.69955 eV ==== + psi = 0.078*[# 5]+0.078*[# 13]+0.078*[# 29]+0.059*[# 9]+0.059*[# 17] + +0.059*[# 21]+0.059*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.69934 eV ==== + psi = 0.117*[# 1]+0.059*[# 9]+0.059*[# 17]+0.059*[# 21]+0.059*[# 25] + +0.047*[# 7]+0.047*[# 16]+0.047*[# 30]+0.039*[# 5]+0.039*[# 13] + +0.039*[# 29]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.129 +==== e( 7) = 1.70960 eV ==== + psi = 0.051*[# 5]+0.051*[# 13]+0.051*[# 29]+0.046*[# 9]+0.046*[# 17] + +0.046*[# 21]+0.046*[# 25]+0.036*[# 7]+0.036*[# 16]+0.036*[# 30] + +0.029*[# 1]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18] + +0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24] + +0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.014*[# 6]+0.014*[# 8] + +0.014*[# 14]+0.014*[# 15]+0.014*[# 31]+0.014*[# 32]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.796 +==== e( 8) = 1.71009 eV ==== + psi = 0.062*[# 1]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.030*[# 6]+0.030*[# 8]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 31]+0.030*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 0.933 +==== e( 9) = 2.10371 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.10436 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 6]+0.049*[# 8] + +0.049*[# 14]+0.049*[# 15]+0.049*[# 31]+0.049*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.017*[# 1]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + +0.009*[# 9]+0.009*[# 17]+0.009*[# 21]+0.009*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 1.048 +==== e( 11) = 3.36740 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.039*[# 7]+0.039*[# 16] + +0.039*[# 30]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 18] + +0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23]+0.034*[# 24] + +0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32] + |psi|^2 = 0.828 +==== e( 12) = 3.36742 eV ==== + psi = 0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.039*[# 2]+0.039*[# 3] + +0.039*[# 4]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.883 +==== e( 13) = 4.14946 eV ==== + psi = 0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.028*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.988 +==== e( 14) = 4.14988 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 8] + +0.038*[# 14]+0.038*[# 15]+0.038*[# 31]+0.038*[# 32]+0.029*[# 10] + +0.029*[# 11]+0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.002*[# 1]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.820 +==== e( 15) = 4.40345 eV ==== + psi = 0.110*[# 7]+0.110*[# 16]+0.110*[# 30]+0.058*[# 10]+0.058*[# 11] + +0.058*[# 12]+0.058*[# 18]+0.058*[# 19]+0.058*[# 20]+0.058*[# 22] + +0.058*[# 23]+0.058*[# 24]+0.058*[# 26]+0.058*[# 27]+0.058*[# 28] + +0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + |psi|^2 = 1.390 +==== e( 16) = 4.40456 eV ==== + psi = 0.101*[# 2]+0.101*[# 3]+0.101*[# 4]+0.051*[# 10]+0.051*[# 11] + +0.051*[# 12]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20]+0.051*[# 22] + +0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27]+0.051*[# 28] + +0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30] + |psi|^2 = 1.223 + + k = 0.0000000000 0.3333333333 0.5000000000 +==== e( 1) = -4.30426 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.30321 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4]+0.004*[# 10]+0.004*[# 11]+0.004*[# 12]+0.004*[# 18] + +0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23]+0.004*[# 24] + +0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 6]+0.004*[# 8] + +0.004*[# 14]+0.004*[# 15]+0.004*[# 31]+0.004*[# 32]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.808 +==== e( 3) = -3.08338 eV ==== + psi = 0.113*[# 5]+0.113*[# 13]+0.113*[# 29]+0.084*[# 9]+0.084*[# 17] + +0.084*[# 21]+0.084*[# 25]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14] + +0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.019*[# 10]+0.019*[# 11] + +0.019*[# 12]+0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22] + +0.019*[# 23]+0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28] + +0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.005*[# 2]+0.005*[# 3] + +0.005*[# 4] + |psi|^2 = 1.121 +==== e( 4) = -3.08238 eV ==== + psi = 0.169*[# 1]+0.084*[# 9]+0.084*[# 17]+0.084*[# 21]+0.084*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15] + +0.011*[# 31]+0.011*[# 32]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12] + +0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23] + +0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.005*[# 7] + +0.005*[# 16]+0.005*[# 30] + |psi|^2 = 0.935 +==== e( 5) = -0.06735 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.060*[# 9]+0.060*[# 17] + +0.060*[# 21]+0.060*[# 25]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + +0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19] + +0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26] + +0.021*[# 27]+0.021*[# 28]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 16]+0.018*[# 30]+0.018*[# 31] + +0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.06705 eV ==== + psi = 0.121*[# 1]+0.060*[# 9]+0.060*[# 17]+0.060*[# 21]+0.060*[# 25] + +0.048*[# 7]+0.048*[# 16]+0.048*[# 30]+0.040*[# 5]+0.040*[# 13] + +0.040*[# 29]+0.036*[# 2]+0.036*[# 3]+0.036*[# 4]+0.030*[# 10] + +0.030*[# 11]+0.030*[# 12]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 1.211 +==== e( 7) = 1.46284 eV ==== + psi = 0.102*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.019*[# 7] + +0.019*[# 16]+0.019*[# 30]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.011*[# 2] + +0.011*[# 3]+0.011*[# 4] + |psi|^2 = 0.832 +==== e( 8) = 1.46285 eV ==== + psi = 0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.039*[# 6]+0.039*[# 8]+0.039*[# 14] + +0.039*[# 15]+0.039*[# 31]+0.039*[# 32]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.019*[# 2]+0.019*[# 3]+0.019*[# 4]+0.011*[# 7]+0.011*[# 16] + +0.011*[# 30] + |psi|^2 = 1.050 +==== e( 9) = 1.95717 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 1.95751 eV ==== + psi = 0.065*[# 6]+0.065*[# 8]+0.065*[# 14]+0.065*[# 15]+0.065*[# 31] + +0.065*[# 32]+0.046*[# 10]+0.046*[# 11]+0.046*[# 12]+0.046*[# 18] + +0.046*[# 19]+0.046*[# 20]+0.046*[# 22]+0.046*[# 23]+0.046*[# 24] + +0.046*[# 26]+0.046*[# 27]+0.046*[# 28]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.018*[# 7]+0.018*[# 16]+0.018*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 1.159 +==== e( 11) = 3.02286 eV ==== + psi = 0.065*[# 7]+0.065*[# 16]+0.065*[# 30]+0.045*[# 2]+0.045*[# 3] + +0.045*[# 4]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.020*[# 1] + +0.010*[# 9]+0.010*[# 17]+0.010*[# 21]+0.010*[# 25]+0.007*[# 5] + +0.007*[# 13]+0.007*[# 29] + |psi|^2 = 1.115 +==== e( 12) = 3.02323 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.058*[# 7]+0.058*[# 16] + +0.058*[# 30]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 18] + +0.050*[# 19]+0.050*[# 20]+0.050*[# 22]+0.050*[# 23]+0.050*[# 24] + +0.050*[# 26]+0.050*[# 27]+0.050*[# 28]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.013*[# 5] + +0.013*[# 13]+0.013*[# 29]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25] + |psi|^2 = 1.281 +==== e( 13) = 4.06622 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 4.06644 eV ==== + psi = 0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.025*[# 10]+0.025*[# 11] + +0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20]+0.025*[# 22] + +0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27]+0.025*[# 28] + +0.022*[# 6]+0.022*[# 8]+0.022*[# 14]+0.022*[# 15]+0.022*[# 31] + +0.022*[# 32]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.623 +==== e( 15) = 4.88257 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.040*[# 7]+0.040*[# 16] + +0.040*[# 30]+0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 1.023 +==== e( 16) = 4.88277 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20] + +0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27] + +0.027*[# 28]+0.007*[# 7]+0.007*[# 16]+0.007*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.656 + + k = 0.1666666667 0.3333333333 0.5000000000 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.005*[# 10]+0.005*[# 11]+0.005*[# 12]+0.005*[# 18] + +0.005*[# 19]+0.005*[# 20]+0.005*[# 22]+0.005*[# 23]+0.005*[# 24] + +0.005*[# 26]+0.005*[# 27]+0.005*[# 28]+0.005*[# 6]+0.005*[# 8] + +0.005*[# 14]+0.005*[# 15]+0.005*[# 31]+0.005*[# 32]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 0.836 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14] + +0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.017*[# 10]+0.017*[# 11] + +0.017*[# 12]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20]+0.017*[# 22] + +0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27]+0.017*[# 28] + +0.012*[# 7]+0.012*[# 16]+0.012*[# 30]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 1.118 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.012*[# 2]+0.012*[# 3] + +0.012*[# 4]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15] + +0.011*[# 31]+0.011*[# 32]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12] + +0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23] + +0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.009*[# 7] + +0.009*[# 16]+0.009*[# 30] + |psi|^2 = 0.960 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.038*[# 2]+0.038*[# 3] + +0.038*[# 4]+0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15] + +0.032*[# 31]+0.032*[# 32]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.021*[# 7] + +0.021*[# 16]+0.021*[# 30] + |psi|^2 = 1.123 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.036*[# 7]+0.036*[# 16]+0.036*[# 30] + +0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.019*[# 1]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.930 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.044*[# 9] + +0.044*[# 17]+0.044*[# 21]+0.044*[# 25]+0.035*[# 5]+0.035*[# 13] + +0.035*[# 29]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.015*[# 7] + +0.015*[# 16]+0.015*[# 30] + |psi|^2 = 1.062 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.063*[# 6]+0.063*[# 8]+0.063*[# 14]+0.063*[# 15]+0.063*[# 31] + +0.063*[# 32]+0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.029*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.010*[# 5]+0.010*[# 13]+0.010*[# 29]+0.008*[# 7] + +0.008*[# 16]+0.008*[# 30] + |psi|^2 = 1.225 +==== e( 11) = 3.70118 eV ==== + psi = 0.057*[# 7]+0.057*[# 16]+0.057*[# 30]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.031*[# 6]+0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31] + +0.031*[# 32]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.967 +==== e( 12) = 3.70168 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.045*[# 10]+0.045*[# 11] + +0.045*[# 12]+0.045*[# 18]+0.045*[# 19]+0.045*[# 20]+0.045*[# 22] + +0.045*[# 23]+0.045*[# 24]+0.045*[# 26]+0.045*[# 27]+0.045*[# 28] + +0.045*[# 7]+0.045*[# 16]+0.045*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.028*[# 1] + +0.014*[# 9]+0.014*[# 17]+0.014*[# 21]+0.014*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 1.199 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.025*[# 10]+0.025*[# 11] + +0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20]+0.025*[# 22] + +0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27]+0.025*[# 28] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30]+0.002*[# 1] + + |psi|^2 = 0.608 +==== e( 15) = 4.84656 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.012*[# 2]+0.012*[# 3]+0.012*[# 4]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 1.118 +==== e( 16) = 4.84692 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.030*[# 10] + +0.030*[# 11]+0.030*[# 12]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.007*[# 7]+0.007*[# 16]+0.007*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.737 + + k = 0.3333333333 0.3333333333 0.5000000000 +==== e( 1) = -3.94104 eV ==== + psi = 0.122*[# 5]+0.122*[# 13]+0.122*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.94002 eV ==== + psi = 0.182*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.061*[# 5]+0.061*[# 13]+0.061*[# 29]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15] + +0.008*[# 31]+0.008*[# 32]+0.007*[# 10]+0.007*[# 11]+0.007*[# 12] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.910 +==== e( 3) = -3.23789 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.094*[# 9]+0.094*[# 17] + +0.094*[# 21]+0.094*[# 25]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14] + +0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.014*[# 10]+0.014*[# 11] + +0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22] + +0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28] + +0.012*[# 2]+0.012*[# 3]+0.012*[# 4]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 1.086 +==== e( 4) = -3.23693 eV ==== + psi = 0.189*[# 1]+0.094*[# 9]+0.094*[# 17]+0.094*[# 21]+0.094*[# 25] + +0.063*[# 5]+0.063*[# 13]+0.063*[# 29]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 14]+0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.008*[# 2] + +0.008*[# 3]+0.008*[# 4] + |psi|^2 = 1.001 +==== e( 5) = -0.73636 eV ==== + psi = 0.073*[# 1]+0.058*[# 7]+0.058*[# 16]+0.058*[# 30]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.024*[# 5]+0.024*[# 13]+0.024*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.018*[# 2] + +0.018*[# 3]+0.018*[# 4] + |psi|^2 = 0.989 +==== e( 6) = -0.73621 eV ==== + psi = 0.048*[# 5]+0.048*[# 13]+0.048*[# 29]+0.040*[# 2]+0.040*[# 3] + +0.040*[# 4]+0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 31]+0.040*[# 32]+0.036*[# 9]+0.036*[# 17]+0.036*[# 21] + +0.036*[# 25]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28] + |psi|^2 = 1.015 +==== e( 7) = 0.03076 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.039*[# 9]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.038*[# 6]+0.038*[# 8]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 31]+0.038*[# 32]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.016*[# 1]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.997 +==== e( 8) = 0.03135 eV ==== + psi = 0.062*[# 1]+0.057*[# 2]+0.057*[# 3]+0.057*[# 4]+0.039*[# 9] + +0.039*[# 17]+0.039*[# 21]+0.039*[# 25]+0.031*[# 5]+0.031*[# 13] + +0.031*[# 29]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.022*[# 7]+0.022*[# 16] + +0.022*[# 30]+0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.023 +==== e( 9) = 3.53934 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.990 +==== e( 10) = 3.54036 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.061*[# 6]+0.061*[# 8] + +0.061*[# 14]+0.061*[# 15]+0.061*[# 31]+0.061*[# 32]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.035*[# 1]+0.017*[# 9]+0.017*[# 17]+0.017*[# 21] + +0.017*[# 25]+0.012*[# 5]+0.012*[# 13]+0.012*[# 29]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 1.253 +==== e( 11) = 4.50427 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22] + +0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + +0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15]+0.018*[# 31] + +0.018*[# 32]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + |psi|^2 = 0.531 +==== e( 12) = 4.50435 eV ==== + psi = 0.059*[# 7]+0.059*[# 16]+0.059*[# 30]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 18] + +0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24] + +0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.793 +==== e( 13) = 4.57402 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.024*[# 1]+0.017*[# 2] + +0.017*[# 3]+0.017*[# 4]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29] + |psi|^2 = 0.987 +==== e( 14) = 4.57418 eV ==== + psi = 0.023*[# 7]+0.023*[# 16]+0.023*[# 30]+0.019*[# 10]+0.019*[# 11] + +0.019*[# 12]+0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22] + +0.019*[# 23]+0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.016*[# 5] + +0.016*[# 13]+0.016*[# 29]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25] + |psi|^2 = 0.560 +==== e( 15) = 4.74870 eV ==== + psi = 0.128*[# 7]+0.128*[# 16]+0.128*[# 30]+0.065*[# 10]+0.065*[# 11] + +0.065*[# 12]+0.065*[# 18]+0.065*[# 19]+0.065*[# 20]+0.065*[# 22] + +0.065*[# 23]+0.065*[# 24]+0.065*[# 26]+0.065*[# 27]+0.065*[# 28] + +0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32] + |psi|^2 = 1.569 +==== e( 16) = 4.74983 eV ==== + psi = 0.088*[# 2]+0.088*[# 3]+0.088*[# 4]+0.049*[# 6]+0.049*[# 8] + +0.049*[# 14]+0.049*[# 15]+0.049*[# 31]+0.049*[# 32]+0.048*[# 10] + +0.048*[# 11]+0.048*[# 12]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.005*[# 7]+0.005*[# 16]+0.005*[# 30] + |psi|^2 = 1.142 + + k = 0.5000000000 0.3333333333 0.5000000000 +==== e( 1) = -3.56633 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.009*[# 2]+0.009*[# 3]+0.009*[# 4] + +0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15]+0.007*[# 31] + +0.007*[# 32] + |psi|^2 = 0.995 +==== e( 2) = -3.56624 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.012*[# 2]+0.012*[# 3]+0.012*[# 4] + +0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15]+0.011*[# 31] + +0.011*[# 32]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.995 +==== e( 3) = -3.56624 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.010*[# 10]+0.010*[# 11] + +0.010*[# 12]+0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22] + +0.010*[# 23]+0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28] + +0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.995 +==== e( 4) = -3.56434 eV ==== + psi = 0.377*[# 1]+0.095*[# 9]+0.095*[# 17]+0.095*[# 21]+0.095*[# 25] + +0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.006*[# 6]+0.006*[# 8] + +0.006*[# 14]+0.006*[# 15]+0.006*[# 31]+0.006*[# 32] + |psi|^2 = 0.995 +==== e( 5) = -0.56737 eV ==== + psi = 0.107*[# 7]+0.107*[# 16]+0.107*[# 30]+0.058*[# 1]+0.035*[# 9] + +0.035*[# 17]+0.035*[# 21]+0.035*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.028*[# 5]+0.028*[# 13]+0.028*[# 29]+0.005*[# 2]+0.005*[# 3] + +0.005*[# 4]+0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.988 +==== e( 6) = -0.56683 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.035*[# 9] + +0.035*[# 17]+0.035*[# 21]+0.035*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.002*[# 7]+0.002*[# 16] + +0.002*[# 30] + |psi|^2 = 0.988 +==== e( 7) = -0.56683 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.035*[# 9] + +0.035*[# 17]+0.035*[# 21]+0.035*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + |psi|^2 = 0.988 +==== e( 8) = -0.56653 eV ==== + psi = 0.084*[# 1]+0.067*[# 2]+0.067*[# 3]+0.067*[# 4]+0.035*[# 9] + +0.035*[# 17]+0.035*[# 21]+0.035*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.007*[# 7] + +0.007*[# 16]+0.007*[# 30] + |psi|^2 = 0.988 +==== e( 9) = 4.26946 eV ==== + psi = 0.142*[# 7]+0.142*[# 16]+0.142*[# 30]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.015*[# 5]+0.015*[# 13]+0.015*[# 29]+0.011*[# 9]+0.011*[# 17] + +0.011*[# 21]+0.011*[# 25]+0.003*[# 6]+0.003*[# 8]+0.003*[# 14] + +0.003*[# 15]+0.003*[# 31]+0.003*[# 32]+0.001*[# 2]+0.001*[# 3] + +0.001*[# 4] + |psi|^2 = 0.988 +==== e( 10) = 4.27017 eV ==== + psi = 0.068*[# 6]+0.068*[# 8]+0.068*[# 14]+0.068*[# 15]+0.068*[# 31] + +0.068*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.015*[# 5]+0.015*[# 13] + +0.015*[# 29]+0.011*[# 9]+0.011*[# 17]+0.011*[# 21]+0.011*[# 25] + +0.010*[# 2]+0.010*[# 3]+0.010*[# 4]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.988 +==== e( 11) = 4.27017 eV ==== + psi = 0.055*[# 6]+0.055*[# 8]+0.055*[# 14]+0.055*[# 15]+0.055*[# 31] + +0.055*[# 32]+0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.015*[# 5]+0.015*[# 13]+0.015*[# 29]+0.011*[# 9] + +0.011*[# 17]+0.011*[# 21]+0.011*[# 25] + |psi|^2 = 0.988 +==== e( 12) = 4.27105 eV ==== + psi = 0.100*[# 2]+0.100*[# 3]+0.100*[# 4]+0.046*[# 1]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15] + +0.023*[# 31]+0.023*[# 32]+0.011*[# 9]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.004*[# 7]+0.004*[# 16]+0.004*[# 30] + |psi|^2 = 0.988 +==== e( 13) = 4.92638 eV ==== + psi = 0.164*[# 7]+0.164*[# 16]+0.164*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.988 +==== e( 14) = 4.92678 eV ==== + psi = 0.082*[# 6]+0.082*[# 8]+0.082*[# 14]+0.082*[# 15]+0.082*[# 31] + +0.082*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + |psi|^2 = 0.988 +==== e( 15) = 4.92770 eV ==== + psi = 0.065*[# 6]+0.065*[# 8]+0.065*[# 14]+0.065*[# 15]+0.065*[# 31] + +0.065*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4] + |psi|^2 = 0.988 +==== e( 16) = 4.92770 eV ==== + psi = 0.082*[# 7]+0.082*[# 16]+0.082*[# 30]+0.048*[# 2]+0.048*[# 3] + +0.048*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.017*[# 6]+0.017*[# 8] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 31]+0.017*[# 32] + |psi|^2 = 0.988 + + k = 0.6666666667 0.3333333333 0.5000000000 +==== e( 1) = -3.94104 eV ==== + psi = 0.122*[# 5]+0.122*[# 13]+0.122*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.94002 eV ==== + psi = 0.182*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.061*[# 5]+0.061*[# 13]+0.061*[# 29]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15] + +0.008*[# 31]+0.008*[# 32]+0.007*[# 10]+0.007*[# 11]+0.007*[# 12] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.910 +==== e( 3) = -3.23789 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.094*[# 9]+0.094*[# 17] + +0.094*[# 21]+0.094*[# 25]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14] + +0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.014*[# 10]+0.014*[# 11] + +0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22] + +0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28] + +0.012*[# 2]+0.012*[# 3]+0.012*[# 4]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 1.086 +==== e( 4) = -3.23693 eV ==== + psi = 0.189*[# 1]+0.094*[# 9]+0.094*[# 17]+0.094*[# 21]+0.094*[# 25] + +0.063*[# 5]+0.063*[# 13]+0.063*[# 29]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 14]+0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.008*[# 2] + +0.008*[# 3]+0.008*[# 4] + |psi|^2 = 1.001 +==== e( 5) = -0.73636 eV ==== + psi = 0.073*[# 1]+0.058*[# 7]+0.058*[# 16]+0.058*[# 30]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.024*[# 5]+0.024*[# 13]+0.024*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.018*[# 2] + +0.018*[# 3]+0.018*[# 4] + |psi|^2 = 0.989 +==== e( 6) = -0.73621 eV ==== + psi = 0.048*[# 5]+0.048*[# 13]+0.048*[# 29]+0.040*[# 2]+0.040*[# 3] + +0.040*[# 4]+0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 31]+0.040*[# 32]+0.036*[# 9]+0.036*[# 17]+0.036*[# 21] + +0.036*[# 25]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28] + |psi|^2 = 1.015 +==== e( 7) = 0.03076 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.039*[# 9]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.038*[# 6]+0.038*[# 8]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 31]+0.038*[# 32]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.016*[# 1]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.997 +==== e( 8) = 0.03135 eV ==== + psi = 0.062*[# 1]+0.057*[# 2]+0.057*[# 3]+0.057*[# 4]+0.039*[# 9] + +0.039*[# 17]+0.039*[# 21]+0.039*[# 25]+0.031*[# 5]+0.031*[# 13] + +0.031*[# 29]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.022*[# 7]+0.022*[# 16] + +0.022*[# 30]+0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.023 +==== e( 9) = 3.53934 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.990 +==== e( 10) = 3.54036 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.061*[# 6]+0.061*[# 8] + +0.061*[# 14]+0.061*[# 15]+0.061*[# 31]+0.061*[# 32]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.035*[# 1]+0.017*[# 9]+0.017*[# 17]+0.017*[# 21] + +0.017*[# 25]+0.012*[# 5]+0.012*[# 13]+0.012*[# 29]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 1.253 +==== e( 11) = 4.50427 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22] + +0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + +0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15]+0.018*[# 31] + +0.018*[# 32]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + |psi|^2 = 0.531 +==== e( 12) = 4.50435 eV ==== + psi = 0.059*[# 7]+0.059*[# 16]+0.059*[# 30]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 18] + +0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24] + +0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.793 +==== e( 13) = 4.57402 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.024*[# 1]+0.017*[# 2] + +0.017*[# 3]+0.017*[# 4]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29] + |psi|^2 = 0.987 +==== e( 14) = 4.57418 eV ==== + psi = 0.023*[# 7]+0.023*[# 16]+0.023*[# 30]+0.019*[# 10]+0.019*[# 11] + +0.019*[# 12]+0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22] + +0.019*[# 23]+0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.016*[# 5] + +0.016*[# 13]+0.016*[# 29]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25] + |psi|^2 = 0.560 +==== e( 15) = 4.74870 eV ==== + psi = 0.128*[# 7]+0.128*[# 16]+0.128*[# 30]+0.065*[# 10]+0.065*[# 11] + +0.065*[# 12]+0.065*[# 18]+0.065*[# 19]+0.065*[# 20]+0.065*[# 22] + +0.065*[# 23]+0.065*[# 24]+0.065*[# 26]+0.065*[# 27]+0.065*[# 28] + +0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32] + |psi|^2 = 1.569 +==== e( 16) = 4.74983 eV ==== + psi = 0.088*[# 2]+0.088*[# 3]+0.088*[# 4]+0.049*[# 6]+0.049*[# 8] + +0.049*[# 14]+0.049*[# 15]+0.049*[# 31]+0.049*[# 32]+0.048*[# 10] + +0.048*[# 11]+0.048*[# 12]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.005*[# 7]+0.005*[# 16]+0.005*[# 30] + |psi|^2 = 1.142 + + k = 0.8333333333 0.3333333333 0.5000000000 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.005*[# 10]+0.005*[# 11]+0.005*[# 12]+0.005*[# 18] + +0.005*[# 19]+0.005*[# 20]+0.005*[# 22]+0.005*[# 23]+0.005*[# 24] + +0.005*[# 26]+0.005*[# 27]+0.005*[# 28]+0.005*[# 6]+0.005*[# 8] + +0.005*[# 14]+0.005*[# 15]+0.005*[# 31]+0.005*[# 32]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 0.836 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14] + +0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.017*[# 10]+0.017*[# 11] + +0.017*[# 12]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20]+0.017*[# 22] + +0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27]+0.017*[# 28] + +0.012*[# 7]+0.012*[# 16]+0.012*[# 30]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 1.118 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.012*[# 2]+0.012*[# 3] + +0.012*[# 4]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15] + +0.011*[# 31]+0.011*[# 32]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12] + +0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23] + +0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.009*[# 7] + +0.009*[# 16]+0.009*[# 30] + |psi|^2 = 0.960 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.038*[# 2]+0.038*[# 3] + +0.038*[# 4]+0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15] + +0.032*[# 31]+0.032*[# 32]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.021*[# 7] + +0.021*[# 16]+0.021*[# 30] + |psi|^2 = 1.123 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.036*[# 7]+0.036*[# 16]+0.036*[# 30] + +0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.019*[# 1]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.930 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.044*[# 9] + +0.044*[# 17]+0.044*[# 21]+0.044*[# 25]+0.035*[# 5]+0.035*[# 13] + +0.035*[# 29]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.015*[# 7] + +0.015*[# 16]+0.015*[# 30] + |psi|^2 = 1.062 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.063*[# 6]+0.063*[# 8]+0.063*[# 14]+0.063*[# 15]+0.063*[# 31] + +0.063*[# 32]+0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.029*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.010*[# 5]+0.010*[# 13]+0.010*[# 29]+0.008*[# 7] + +0.008*[# 16]+0.008*[# 30] + |psi|^2 = 1.225 +==== e( 11) = 3.70118 eV ==== + psi = 0.057*[# 7]+0.057*[# 16]+0.057*[# 30]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.031*[# 6]+0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31] + +0.031*[# 32]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.967 +==== e( 12) = 3.70168 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.045*[# 10]+0.045*[# 11] + +0.045*[# 12]+0.045*[# 18]+0.045*[# 19]+0.045*[# 20]+0.045*[# 22] + +0.045*[# 23]+0.045*[# 24]+0.045*[# 26]+0.045*[# 27]+0.045*[# 28] + +0.045*[# 7]+0.045*[# 16]+0.045*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.028*[# 1] + +0.014*[# 9]+0.014*[# 17]+0.014*[# 21]+0.014*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 1.199 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.025*[# 10]+0.025*[# 11] + +0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20]+0.025*[# 22] + +0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27]+0.025*[# 28] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30]+0.002*[# 1] + + |psi|^2 = 0.608 +==== e( 15) = 4.84656 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.012*[# 2]+0.012*[# 3]+0.012*[# 4]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 1.118 +==== e( 16) = 4.84692 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.030*[# 10] + +0.030*[# 11]+0.030*[# 12]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.007*[# 7]+0.007*[# 16]+0.007*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.737 + + k = 0.0000000000 0.5000000000 0.5000000000 +==== e( 1) = -3.77594 eV ==== + psi = 0.115*[# 5]+0.115*[# 13]+0.115*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.045*[# 7]+0.045*[# 16]+0.045*[# 30] + +0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19] + +0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26] + +0.013*[# 27]+0.013*[# 28]+0.005*[# 2]+0.005*[# 3]+0.005*[# 4] + + |psi|^2 = 0.994 +==== e( 2) = -3.77569 eV ==== + psi = 0.115*[# 5]+0.115*[# 13]+0.115*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.019*[# 2]+0.019*[# 3]+0.019*[# 4] + +0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18]+0.008*[# 19] + +0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24]+0.008*[# 26] + +0.008*[# 27]+0.008*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14] + +0.007*[# 15]+0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.890 +==== e( 3) = -3.77569 eV ==== + psi = 0.115*[# 5]+0.115*[# 13]+0.115*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4] + +0.016*[# 6]+0.016*[# 8]+0.016*[# 14]+0.016*[# 15]+0.016*[# 31] + +0.016*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18] + +0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24] + +0.013*[# 26]+0.013*[# 27]+0.013*[# 28] + |psi|^2 = 0.994 +==== e( 4) = -3.77387 eV ==== + psi = 0.345*[# 1]+0.086*[# 9]+0.086*[# 17]+0.086*[# 21]+0.086*[# 25] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.890 +==== e( 5) = 0.66844 eV ==== + psi = 0.072*[# 5]+0.072*[# 13]+0.072*[# 29]+0.054*[# 9]+0.054*[# 17] + +0.054*[# 21]+0.054*[# 25]+0.035*[# 6]+0.035*[# 8]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 31]+0.035*[# 32]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 18] + +0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23]+0.023*[# 24] + +0.023*[# 26]+0.023*[# 27]+0.023*[# 28] + |psi|^2 = 0.992 +==== e( 6) = 0.66844 eV ==== + psi = 0.072*[# 5]+0.072*[# 13]+0.072*[# 29]+0.054*[# 9]+0.054*[# 17] + +0.054*[# 21]+0.054*[# 25]+0.036*[# 6]+0.036*[# 8]+0.036*[# 14] + +0.036*[# 15]+0.036*[# 31]+0.036*[# 32]+0.030*[# 7]+0.030*[# 16] + +0.030*[# 30]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4] + |psi|^2 = 1.133 +==== e( 7) = 0.66848 eV ==== + psi = 0.072*[# 5]+0.072*[# 13]+0.072*[# 29]+0.055*[# 2]+0.055*[# 3] + +0.055*[# 4]+0.054*[# 9]+0.054*[# 17]+0.054*[# 21]+0.054*[# 25] + +0.023*[# 7]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 16] + +0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23] + +0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.023*[# 30] + +0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15]+0.007*[# 31] + +0.007*[# 32] + |psi|^2 = 0.992 +==== e( 8) = 0.66874 eV ==== + psi = 0.217*[# 1]+0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.054*[# 9] + +0.054*[# 17]+0.054*[# 21]+0.054*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31] + +0.027*[# 32] + |psi|^2 = 1.133 +==== e( 9) = 2.36032 eV ==== + psi = 0.080*[# 7]+0.080*[# 16]+0.080*[# 30]+0.038*[# 10]+0.038*[# 11] + +0.038*[# 12]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20]+0.038*[# 22] + +0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27]+0.038*[# 28] + +0.037*[# 1]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 31]+0.037*[# 32]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.991 +==== e( 10) = 2.36083 eV ==== + psi = 0.089*[# 6]+0.089*[# 8]+0.089*[# 14]+0.089*[# 15]+0.089*[# 31] + +0.089*[# 32]+0.049*[# 10]+0.049*[# 11]+0.049*[# 12]+0.049*[# 18] + +0.049*[# 19]+0.049*[# 20]+0.049*[# 22]+0.049*[# 23]+0.049*[# 24] + +0.049*[# 26]+0.049*[# 27]+0.049*[# 28]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.012*[# 5]+0.012*[# 13]+0.012*[# 29]+0.009*[# 9] + +0.009*[# 17]+0.009*[# 21]+0.009*[# 25] + |psi|^2 = 1.251 +==== e( 11) = 2.36083 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.012*[# 5]+0.012*[# 13]+0.012*[# 29]+0.009*[# 9] + +0.009*[# 17]+0.009*[# 21]+0.009*[# 25] + |psi|^2 = 0.991 +==== e( 12) = 2.36105 eV ==== + psi = 0.080*[# 2]+0.080*[# 3]+0.080*[# 4]+0.077*[# 7]+0.077*[# 16] + +0.077*[# 30]+0.049*[# 10]+0.049*[# 11]+0.049*[# 12]+0.049*[# 18] + +0.049*[# 19]+0.049*[# 20]+0.049*[# 22]+0.049*[# 23]+0.049*[# 24] + +0.049*[# 26]+0.049*[# 27]+0.049*[# 28]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.012*[# 5] + +0.012*[# 13]+0.012*[# 29]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 1.251 +==== e( 13) = 4.82921 eV ==== + psi = 0.165*[# 7]+0.165*[# 16]+0.165*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.989 +==== e( 14) = 4.82971 eV ==== + psi = 0.041*[# 6]+0.041*[# 8]+0.041*[# 14]+0.041*[# 15]+0.041*[# 31] + +0.041*[# 32]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18] + +0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24] + +0.021*[# 26]+0.021*[# 27]+0.021*[# 28] + |psi|^2 = 0.494 +==== e( 15) = 4.83052 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28] + |psi|^2 = 0.989 +==== e( 16) = 4.83052 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28] + |psi|^2 = 0.494 + + k = 0.1666666667 0.5000000000 0.5000000000 +==== e( 1) = -3.71242 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19] + +0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26] + +0.012*[# 27]+0.012*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.71222 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4] + +0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15]+0.011*[# 31] + +0.011*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + |psi|^2 = 0.911 +==== e( 3) = -3.71222 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19] + +0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26] + +0.012*[# 27]+0.012*[# 28]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14] + +0.010*[# 15]+0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -3.71037 eV ==== + psi = 0.353*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.011*[# 6]+0.011*[# 8] + +0.011*[# 14]+0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20] + +0.008*[# 22]+0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27] + +0.008*[# 28] + |psi|^2 = 0.911 +==== e( 5) = 0.12722 eV ==== + psi = 0.098*[# 7]+0.098*[# 16]+0.098*[# 30]+0.045*[# 5]+0.045*[# 13] + +0.045*[# 29]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.041*[# 1]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 0.991 +==== e( 6) = 0.12772 eV ==== + psi = 0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.048*[# 6]+0.048*[# 8] + +0.048*[# 14]+0.048*[# 15]+0.048*[# 31]+0.048*[# 32]+0.044*[# 9] + +0.044*[# 17]+0.044*[# 21]+0.044*[# 25]+0.031*[# 10]+0.031*[# 11] + +0.031*[# 12]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22] + +0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + +0.029*[# 2]+0.029*[# 3]+0.029*[# 4] + |psi|^2 = 1.098 +==== e( 7) = 0.12772 eV ==== + psi = 0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.045*[# 6]+0.045*[# 8] + +0.045*[# 14]+0.045*[# 15]+0.045*[# 31]+0.045*[# 32]+0.044*[# 9] + +0.044*[# 17]+0.044*[# 21]+0.044*[# 25]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + |psi|^2 = 0.991 +==== e( 8) = 0.12828 eV ==== + psi = 0.135*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.031*[# 10]+0.031*[# 11] + +0.031*[# 12]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22] + +0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + +0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.014*[# 5] + +0.014*[# 13]+0.014*[# 29] + |psi|^2 = 1.098 +==== e( 9) = 3.08095 eV ==== + psi = 0.122*[# 7]+0.122*[# 16]+0.122*[# 30]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.020*[# 5]+0.020*[# 13]+0.020*[# 29]+0.016*[# 9]+0.016*[# 17] + +0.016*[# 21]+0.016*[# 25]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14] + +0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.001*[# 1] + |psi|^2 = 0.991 +==== e( 10) = 3.08168 eV ==== + psi = 0.087*[# 6]+0.087*[# 8]+0.087*[# 14]+0.087*[# 15]+0.087*[# 31] + +0.087*[# 32]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.021*[# 5]+0.021*[# 13] + +0.021*[# 29]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.016*[# 9] + +0.016*[# 17]+0.016*[# 21]+0.016*[# 25] + |psi|^2 = 1.278 +==== e( 11) = 3.08168 eV ==== + psi = 0.055*[# 6]+0.055*[# 8]+0.055*[# 14]+0.055*[# 15]+0.055*[# 31] + +0.055*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.021*[# 5]+0.021*[# 13]+0.021*[# 29]+0.016*[# 9] + +0.016*[# 17]+0.016*[# 21]+0.016*[# 25] + |psi|^2 = 0.991 +==== e( 12) = 3.08237 eV ==== + psi = 0.078*[# 2]+0.078*[# 3]+0.078*[# 4]+0.071*[# 7]+0.071*[# 16] + +0.071*[# 30]+0.061*[# 1]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12] + +0.048*[# 18]+0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23] + +0.048*[# 24]+0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.022*[# 6] + +0.022*[# 8]+0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32] + +0.016*[# 9]+0.016*[# 17]+0.016*[# 21]+0.016*[# 25] + |psi|^2 = 1.278 +==== e( 13) = 4.86024 eV ==== + psi = 0.164*[# 7]+0.164*[# 16]+0.164*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.988 +==== e( 14) = 4.86071 eV ==== + psi = 0.041*[# 6]+0.041*[# 8]+0.041*[# 14]+0.041*[# 15]+0.041*[# 31] + +0.041*[# 32]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18] + +0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24] + +0.021*[# 26]+0.021*[# 27]+0.021*[# 28] + |psi|^2 = 0.494 +==== e( 15) = 4.86155 eV ==== + psi = 0.057*[# 6]+0.057*[# 8]+0.057*[# 14]+0.057*[# 15]+0.057*[# 31] + +0.057*[# 32]+0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28] + |psi|^2 = 0.988 +==== e( 16) = 4.86155 eV ==== + psi = 0.031*[# 2]+0.031*[# 3]+0.031*[# 4]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28] + |psi|^2 = 0.494 + + k = 0.3333333333 0.5000000000 0.5000000000 +==== e( 1) = -3.56633 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.009*[# 2]+0.009*[# 3]+0.009*[# 4] + +0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15]+0.007*[# 31] + +0.007*[# 32] + |psi|^2 = 0.995 +==== e( 2) = -3.56624 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15]+0.011*[# 31] + +0.011*[# 32]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18] + +0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24] + +0.009*[# 26]+0.009*[# 27]+0.009*[# 28] + |psi|^2 = 0.963 +==== e( 3) = -3.56624 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.025*[# 2]+0.025*[# 3]+0.025*[# 4] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14] + +0.007*[# 15]+0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.995 +==== e( 4) = -3.56434 eV ==== + psi = 0.377*[# 1]+0.095*[# 9]+0.095*[# 17]+0.095*[# 21]+0.095*[# 25] + +0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.009*[# 6]+0.009*[# 8] + +0.009*[# 14]+0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19]+0.009*[# 20] + +0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26]+0.009*[# 27] + +0.009*[# 28] + |psi|^2 = 0.963 +==== e( 5) = -0.56737 eV ==== + psi = 0.107*[# 7]+0.107*[# 16]+0.107*[# 30]+0.058*[# 1]+0.035*[# 9] + +0.035*[# 17]+0.035*[# 21]+0.035*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.028*[# 5]+0.028*[# 13]+0.028*[# 29]+0.005*[# 2]+0.005*[# 3] + +0.005*[# 4]+0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.988 +==== e( 6) = -0.56683 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.039*[# 2] + +0.039*[# 3]+0.039*[# 4]+0.035*[# 9]+0.035*[# 17]+0.035*[# 21] + +0.035*[# 25]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 18] + +0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23]+0.031*[# 24] + +0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + |psi|^2 = 1.027 +==== e( 7) = -0.56683 eV ==== + psi = 0.056*[# 6]+0.056*[# 8]+0.056*[# 14]+0.056*[# 15]+0.056*[# 31] + +0.056*[# 32]+0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.035*[# 9] + +0.035*[# 17]+0.035*[# 21]+0.035*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.988 +==== e( 8) = -0.56653 eV ==== + psi = 0.084*[# 1]+0.045*[# 7]+0.045*[# 16]+0.045*[# 30]+0.038*[# 2] + +0.038*[# 3]+0.038*[# 4]+0.035*[# 9]+0.035*[# 17]+0.035*[# 21] + +0.035*[# 25]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 18] + +0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23]+0.031*[# 24] + +0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29] + |psi|^2 = 1.027 +==== e( 9) = 4.26946 eV ==== + psi = 0.142*[# 7]+0.142*[# 16]+0.142*[# 30]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.015*[# 5]+0.015*[# 13]+0.015*[# 29]+0.011*[# 9]+0.011*[# 17] + +0.011*[# 21]+0.011*[# 25]+0.003*[# 6]+0.003*[# 8]+0.003*[# 14] + +0.003*[# 15]+0.003*[# 31]+0.003*[# 32]+0.001*[# 2]+0.001*[# 3] + +0.001*[# 4] + |psi|^2 = 0.988 +==== e( 10) = 4.27017 eV ==== + psi = 0.105*[# 6]+0.105*[# 8]+0.105*[# 14]+0.105*[# 15]+0.105*[# 31] + +0.105*[# 32]+0.053*[# 10]+0.053*[# 11]+0.053*[# 12]+0.053*[# 18] + +0.053*[# 19]+0.053*[# 20]+0.053*[# 22]+0.053*[# 23]+0.053*[# 24] + +0.053*[# 26]+0.053*[# 27]+0.053*[# 28]+0.015*[# 5]+0.015*[# 13] + +0.015*[# 29]+0.011*[# 9]+0.011*[# 17]+0.011*[# 21]+0.011*[# 25] + +0.002*[# 2]+0.002*[# 3]+0.002*[# 4] + |psi|^2 = 1.364 +==== e( 11) = 4.27017 eV ==== + psi = 0.057*[# 2]+0.057*[# 3]+0.057*[# 4]+0.046*[# 6]+0.046*[# 8] + +0.046*[# 14]+0.046*[# 15]+0.046*[# 31]+0.046*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.015*[# 5]+0.015*[# 13]+0.015*[# 29]+0.011*[# 9] + +0.011*[# 17]+0.011*[# 21]+0.011*[# 25] + |psi|^2 = 0.988 +==== e( 12) = 4.27105 eV ==== + psi = 0.090*[# 2]+0.090*[# 3]+0.090*[# 4]+0.053*[# 10]+0.053*[# 11] + +0.053*[# 12]+0.053*[# 18]+0.053*[# 19]+0.053*[# 20]+0.053*[# 22] + +0.053*[# 23]+0.053*[# 24]+0.053*[# 26]+0.053*[# 27]+0.053*[# 28] + +0.046*[# 1]+0.045*[# 6]+0.045*[# 8]+0.045*[# 14]+0.045*[# 15] + +0.045*[# 31]+0.045*[# 32]+0.032*[# 7]+0.032*[# 16]+0.032*[# 30] + +0.011*[# 9]+0.011*[# 17]+0.011*[# 21]+0.011*[# 25] + |psi|^2 = 1.364 +==== e( 13) = 4.92638 eV ==== + psi = 0.164*[# 7]+0.164*[# 16]+0.164*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.988 +==== e( 14) = 4.92678 eV ==== + psi = 0.041*[# 6]+0.041*[# 8]+0.041*[# 14]+0.041*[# 15]+0.041*[# 31] + +0.041*[# 32]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18] + +0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24] + +0.021*[# 26]+0.021*[# 27]+0.021*[# 28] + |psi|^2 = 0.494 +==== e( 15) = 4.92770 eV ==== + psi = 0.074*[# 6]+0.074*[# 8]+0.074*[# 14]+0.074*[# 15]+0.074*[# 31] + +0.074*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4] + |psi|^2 = 0.988 +==== e( 16) = 4.92770 eV ==== + psi = 0.066*[# 2]+0.066*[# 3]+0.066*[# 4]+0.021*[# 10]+0.021*[# 11] + +0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22] + +0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28] + +0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15]+0.008*[# 31] + +0.008*[# 32] + |psi|^2 = 0.494 + + k = 0.5000000000 0.5000000000 0.5000000000 +==== e( 1) = -3.48009 eV ==== + psi = 0.132*[# 5]+0.132*[# 13]+0.132*[# 29]+0.099*[# 9]+0.099*[# 17] + +0.099*[# 21]+0.099*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15]+0.011*[# 31] + +0.011*[# 32]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18] + +0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24] + +0.009*[# 26]+0.009*[# 27]+0.009*[# 28] + |psi|^2 = 0.996 +==== e( 2) = -3.48009 eV ==== + psi = 0.132*[# 5]+0.132*[# 13]+0.132*[# 29]+0.099*[# 9]+0.099*[# 17] + +0.099*[# 21]+0.099*[# 25]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14] + +0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18] + +0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24] + +0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.996 +==== e( 3) = -3.48009 eV ==== + psi = 0.132*[# 5]+0.132*[# 13]+0.132*[# 29]+0.099*[# 9]+0.099*[# 17] + +0.099*[# 21]+0.099*[# 25]+0.016*[# 2]+0.016*[# 3]+0.016*[# 4] + +0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15]+0.009*[# 31] + +0.009*[# 32]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18] + +0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24] + +0.009*[# 26]+0.009*[# 27]+0.009*[# 28] + |psi|^2 = 0.996 +==== e( 4) = -3.47816 eV ==== + psi = 0.395*[# 1]+0.099*[# 9]+0.099*[# 17]+0.099*[# 21]+0.099*[# 25] + +0.025*[# 7]+0.025*[# 16]+0.025*[# 30]+0.009*[# 10]+0.009*[# 11] + +0.009*[# 12]+0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22] + +0.009*[# 23]+0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28] + +0.004*[# 2]+0.004*[# 3]+0.004*[# 4]+0.002*[# 6]+0.002*[# 8] + +0.002*[# 14]+0.002*[# 15]+0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.996 +==== e( 5) = -0.85332 eV ==== + psi = 0.124*[# 1]+0.123*[# 7]+0.123*[# 16]+0.123*[# 30]+0.031*[# 9] + +0.031*[# 17]+0.031*[# 21]+0.031*[# 25]+0.031*[# 10]+0.031*[# 11] + +0.031*[# 12]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22] + +0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + + |psi|^2 = 0.987 +==== e( 6) = -0.85291 eV ==== + psi = 0.041*[# 6]+0.041*[# 8]+0.041*[# 14]+0.041*[# 15]+0.041*[# 31] + +0.041*[# 32]+0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.040*[# 2] + +0.040*[# 3]+0.040*[# 4]+0.031*[# 9]+0.031*[# 17]+0.031*[# 21] + +0.031*[# 25]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 18] + +0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23]+0.031*[# 24] + +0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + |psi|^2 = 0.987 +==== e( 7) = -0.85291 eV ==== + psi = 0.043*[# 6]+0.043*[# 8]+0.043*[# 14]+0.043*[# 15]+0.043*[# 31] + +0.043*[# 32]+0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.038*[# 2] + +0.038*[# 3]+0.038*[# 4]+0.031*[# 9]+0.031*[# 17]+0.031*[# 21] + +0.031*[# 25]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 18] + +0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23]+0.031*[# 24] + +0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + |psi|^2 = 0.987 +==== e( 8) = -0.85291 eV ==== + psi = 0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.039*[# 6]+0.039*[# 8] + +0.039*[# 14]+0.039*[# 15]+0.039*[# 31]+0.039*[# 32]+0.031*[# 9] + +0.031*[# 17]+0.031*[# 21]+0.031*[# 25]+0.031*[# 10]+0.031*[# 11] + +0.031*[# 12]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22] + +0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + +0.031*[# 2]+0.031*[# 3]+0.031*[# 4]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30] + |psi|^2 = 0.987 +==== e( 9) = 4.96090 eV ==== + psi = 0.165*[# 7]+0.165*[# 16]+0.165*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.988 +==== e( 10) = 4.96090 eV ==== + psi = 0.146*[# 7]+0.146*[# 16]+0.146*[# 30]+0.038*[# 10]+0.038*[# 11] + +0.038*[# 12]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20]+0.038*[# 22] + +0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27]+0.038*[# 28] + +0.003*[# 6]+0.003*[# 8]+0.003*[# 14]+0.003*[# 15]+0.003*[# 31] + +0.003*[# 32] + |psi|^2 = 0.915 +==== e( 11) = 4.96126 eV ==== + psi = 0.066*[# 6]+0.066*[# 8]+0.066*[# 14]+0.066*[# 15]+0.066*[# 31] + +0.066*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30] + |psi|^2 = 0.905 +==== e( 12) = 4.96126 eV ==== + psi = 0.108*[# 6]+0.108*[# 8]+0.108*[# 14]+0.108*[# 15]+0.108*[# 31] + +0.108*[# 32]+0.054*[# 10]+0.054*[# 11]+0.054*[# 12]+0.054*[# 18] + +0.054*[# 19]+0.054*[# 20]+0.054*[# 22]+0.054*[# 23]+0.054*[# 24] + +0.054*[# 26]+0.054*[# 27]+0.054*[# 28] + |psi|^2 = 1.302 +==== e( 13) = 4.96126 eV ==== + psi = 0.082*[# 6]+0.082*[# 8]+0.082*[# 14]+0.082*[# 15]+0.082*[# 31] + +0.082*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + |psi|^2 = 0.988 +==== e( 14) = 4.96254 eV ==== + psi = 0.079*[# 7]+0.079*[# 16]+0.079*[# 30]+0.061*[# 2]+0.061*[# 3] + +0.061*[# 4]+0.045*[# 10]+0.045*[# 11]+0.045*[# 12]+0.045*[# 18] + +0.045*[# 19]+0.045*[# 20]+0.045*[# 22]+0.045*[# 23]+0.045*[# 24] + +0.045*[# 26]+0.045*[# 27]+0.045*[# 28]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.088 +==== e( 15) = 4.96254 eV ==== + psi = 0.155*[# 2]+0.155*[# 3]+0.155*[# 4]+0.050*[# 10]+0.050*[# 11] + +0.050*[# 12]+0.050*[# 18]+0.050*[# 19]+0.050*[# 20]+0.050*[# 22] + +0.050*[# 23]+0.050*[# 24]+0.050*[# 26]+0.050*[# 27]+0.050*[# 28] + +0.022*[# 6]+0.022*[# 8]+0.022*[# 14]+0.022*[# 15]+0.022*[# 31] + +0.022*[# 32] + |psi|^2 = 1.191 +==== e( 16) = 4.96254 eV ==== + psi = 0.069*[# 2]+0.069*[# 3]+0.069*[# 4]+0.034*[# 10]+0.034*[# 11] + +0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22] + +0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28] + +0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31] + +0.027*[# 32]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30] + |psi|^2 = 0.806 + + k = 0.6666666667 0.5000000000 0.5000000000 +==== e( 1) = -3.56633 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.009*[# 2]+0.009*[# 3]+0.009*[# 4] + +0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15]+0.007*[# 31] + +0.007*[# 32] + |psi|^2 = 0.995 +==== e( 2) = -3.56624 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.963 +==== e( 3) = -3.56624 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14] + +0.014*[# 15]+0.014*[# 31]+0.014*[# 32]+0.012*[# 2]+0.012*[# 3] + +0.012*[# 4]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28] + |psi|^2 = 0.995 +==== e( 4) = -3.56434 eV ==== + psi = 0.377*[# 1]+0.095*[# 9]+0.095*[# 17]+0.095*[# 21]+0.095*[# 25] + +0.023*[# 7]+0.023*[# 16]+0.023*[# 30]+0.009*[# 10]+0.009*[# 11] + +0.009*[# 12]+0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22] + +0.009*[# 23]+0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28] + +0.005*[# 6]+0.005*[# 8]+0.005*[# 14]+0.005*[# 15]+0.005*[# 31] + +0.005*[# 32] + |psi|^2 = 0.963 +==== e( 5) = -0.56737 eV ==== + psi = 0.107*[# 7]+0.107*[# 16]+0.107*[# 30]+0.058*[# 1]+0.035*[# 9] + +0.035*[# 17]+0.035*[# 21]+0.035*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.028*[# 5]+0.028*[# 13]+0.028*[# 29]+0.005*[# 2]+0.005*[# 3] + +0.005*[# 4]+0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.988 +==== e( 6) = -0.56683 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.044*[# 6]+0.044*[# 8] + +0.044*[# 14]+0.044*[# 15]+0.044*[# 31]+0.044*[# 32]+0.035*[# 9] + +0.035*[# 17]+0.035*[# 21]+0.035*[# 25]+0.035*[# 2]+0.035*[# 3] + +0.035*[# 4]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 18] + +0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23]+0.031*[# 24] + +0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + |psi|^2 = 1.027 +==== e( 7) = -0.56683 eV ==== + psi = 0.052*[# 6]+0.052*[# 8]+0.052*[# 14]+0.052*[# 15]+0.052*[# 31] + +0.052*[# 32]+0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.035*[# 9] + +0.035*[# 17]+0.035*[# 21]+0.035*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.014*[# 2]+0.014*[# 3]+0.014*[# 4] + |psi|^2 = 0.988 +==== e( 8) = -0.56653 eV ==== + psi = 0.084*[# 1]+0.043*[# 7]+0.043*[# 16]+0.043*[# 30]+0.038*[# 2] + +0.038*[# 3]+0.038*[# 4]+0.035*[# 9]+0.035*[# 17]+0.035*[# 21] + +0.035*[# 25]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 18] + +0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23]+0.031*[# 24] + +0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29] + |psi|^2 = 1.027 +==== e( 9) = 4.26946 eV ==== + psi = 0.142*[# 7]+0.142*[# 16]+0.142*[# 30]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.015*[# 5]+0.015*[# 13]+0.015*[# 29]+0.011*[# 9]+0.011*[# 17] + +0.011*[# 21]+0.011*[# 25]+0.003*[# 6]+0.003*[# 8]+0.003*[# 14] + +0.003*[# 15]+0.003*[# 31]+0.003*[# 32]+0.001*[# 2]+0.001*[# 3] + +0.001*[# 4] + |psi|^2 = 0.988 +==== e( 10) = 4.27017 eV ==== + psi = 0.095*[# 6]+0.095*[# 8]+0.095*[# 14]+0.095*[# 15]+0.095*[# 31] + +0.095*[# 32]+0.053*[# 10]+0.053*[# 11]+0.053*[# 12]+0.053*[# 18] + +0.053*[# 19]+0.053*[# 20]+0.053*[# 22]+0.053*[# 23]+0.053*[# 24] + +0.053*[# 26]+0.053*[# 27]+0.053*[# 28]+0.022*[# 2]+0.022*[# 3] + +0.022*[# 4]+0.015*[# 5]+0.015*[# 13]+0.015*[# 29]+0.011*[# 9] + +0.011*[# 17]+0.011*[# 21]+0.011*[# 25] + |psi|^2 = 1.364 +==== e( 11) = 4.27017 eV ==== + psi = 0.067*[# 6]+0.067*[# 8]+0.067*[# 14]+0.067*[# 15]+0.067*[# 31] + +0.067*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.015*[# 5]+0.015*[# 13]+0.015*[# 29]+0.011*[# 9] + +0.011*[# 17]+0.011*[# 21]+0.011*[# 25] + |psi|^2 = 0.988 +==== e( 12) = 4.27105 eV ==== + psi = 0.090*[# 2]+0.090*[# 3]+0.090*[# 4]+0.053*[# 10]+0.053*[# 11] + +0.053*[# 12]+0.053*[# 18]+0.053*[# 19]+0.053*[# 20]+0.053*[# 22] + +0.053*[# 23]+0.053*[# 24]+0.053*[# 26]+0.053*[# 27]+0.053*[# 28] + +0.046*[# 6]+0.046*[# 8]+0.046*[# 14]+0.046*[# 15]+0.046*[# 31] + +0.046*[# 32]+0.046*[# 1]+0.030*[# 7]+0.030*[# 16]+0.030*[# 30] + +0.011*[# 9]+0.011*[# 17]+0.011*[# 21]+0.011*[# 25] + |psi|^2 = 1.364 +==== e( 13) = 4.92638 eV ==== + psi = 0.164*[# 7]+0.164*[# 16]+0.164*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.988 +==== e( 14) = 4.92678 eV ==== + psi = 0.041*[# 6]+0.041*[# 8]+0.041*[# 14]+0.041*[# 15]+0.041*[# 31] + +0.041*[# 32]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18] + +0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24] + +0.021*[# 26]+0.021*[# 27]+0.021*[# 28] + |psi|^2 = 0.494 +==== e( 15) = 4.92770 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28] + |psi|^2 = 0.989 +==== e( 16) = 4.92770 eV ==== + psi = 0.039*[# 6]+0.039*[# 8]+0.039*[# 14]+0.039*[# 15]+0.039*[# 31] + +0.039*[# 32]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18] + +0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24] + +0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4] + |psi|^2 = 0.494 + + k = 0.8333333333 0.5000000000 0.5000000000 +==== e( 1) = -3.71242 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19] + +0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26] + +0.012*[# 27]+0.012*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.71222 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14] + +0.013*[# 15]+0.013*[# 31]+0.013*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.008*[# 2]+0.008*[# 3]+0.008*[# 4] + |psi|^2 = 0.911 +==== e( 3) = -3.71222 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.038*[# 2]+0.038*[# 3]+0.038*[# 4] + +0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19] + +0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26] + +0.012*[# 27]+0.012*[# 28]+0.005*[# 6]+0.005*[# 8]+0.005*[# 14] + +0.005*[# 15]+0.005*[# 31]+0.005*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -3.71037 eV ==== + psi = 0.353*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 14]+0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20] + +0.008*[# 22]+0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27] + +0.008*[# 28] + |psi|^2 = 0.911 +==== e( 5) = 0.12722 eV ==== + psi = 0.098*[# 7]+0.098*[# 16]+0.098*[# 30]+0.045*[# 5]+0.045*[# 13] + +0.045*[# 29]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.041*[# 1]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 0.991 +==== e( 6) = 0.12772 eV ==== + psi = 0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.052*[# 6]+0.052*[# 8] + +0.052*[# 14]+0.052*[# 15]+0.052*[# 31]+0.052*[# 32]+0.044*[# 9] + +0.044*[# 17]+0.044*[# 21]+0.044*[# 25]+0.031*[# 10]+0.031*[# 11] + +0.031*[# 12]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22] + +0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + |psi|^2 = 1.098 +==== e( 7) = 0.12772 eV ==== + psi = 0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.036*[# 2]+0.036*[# 3]+0.036*[# 4] + +0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + |psi|^2 = 0.991 +==== e( 8) = 0.12828 eV ==== + psi = 0.135*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.031*[# 10]+0.031*[# 11] + +0.031*[# 12]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22] + +0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + +0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.014*[# 5] + +0.014*[# 13]+0.014*[# 29] + |psi|^2 = 1.098 +==== e( 9) = 3.08095 eV ==== + psi = 0.122*[# 7]+0.122*[# 16]+0.122*[# 30]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.020*[# 5]+0.020*[# 13]+0.020*[# 29]+0.016*[# 9]+0.016*[# 17] + +0.016*[# 21]+0.016*[# 25]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14] + +0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.001*[# 1] + |psi|^2 = 0.991 +==== e( 10) = 3.08168 eV ==== + psi = 0.084*[# 6]+0.084*[# 8]+0.084*[# 14]+0.084*[# 15]+0.084*[# 31] + +0.084*[# 32]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.021*[# 5]+0.021*[# 13]+0.021*[# 29]+0.016*[# 9] + +0.016*[# 17]+0.016*[# 21]+0.016*[# 25] + |psi|^2 = 1.278 +==== e( 11) = 3.08168 eV ==== + psi = 0.062*[# 6]+0.062*[# 8]+0.062*[# 14]+0.062*[# 15]+0.062*[# 31] + +0.062*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 5]+0.021*[# 13]+0.021*[# 29]+0.016*[# 9] + +0.016*[# 17]+0.016*[# 21]+0.016*[# 25] + |psi|^2 = 0.991 +==== e( 12) = 3.08237 eV ==== + psi = 0.088*[# 7]+0.088*[# 16]+0.088*[# 30]+0.078*[# 2]+0.078*[# 3] + +0.078*[# 4]+0.061*[# 1]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12] + +0.048*[# 18]+0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23] + +0.048*[# 24]+0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.016*[# 9] + +0.016*[# 17]+0.016*[# 21]+0.016*[# 25]+0.013*[# 6]+0.013*[# 8] + +0.013*[# 14]+0.013*[# 15]+0.013*[# 31]+0.013*[# 32] + |psi|^2 = 1.278 +==== e( 13) = 4.86024 eV ==== + psi = 0.164*[# 7]+0.164*[# 16]+0.164*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.988 +==== e( 14) = 4.86071 eV ==== + psi = 0.041*[# 6]+0.041*[# 8]+0.041*[# 14]+0.041*[# 15]+0.041*[# 31] + +0.041*[# 32]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18] + +0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24] + +0.021*[# 26]+0.021*[# 27]+0.021*[# 28] + |psi|^2 = 0.494 +==== e( 15) = 4.86155 eV ==== + psi = 0.073*[# 6]+0.073*[# 8]+0.073*[# 14]+0.073*[# 15]+0.073*[# 31] + +0.073*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4] + |psi|^2 = 0.988 +==== e( 16) = 4.86155 eV ==== + psi = 0.063*[# 2]+0.063*[# 3]+0.063*[# 4]+0.021*[# 10]+0.021*[# 11] + +0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22] + +0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28] + +0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15]+0.010*[# 31] + +0.010*[# 32] + |psi|^2 = 0.494 + + k = 0.0000000000 0.6666666667 0.5000000000 +==== e( 1) = -4.30426 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.30321 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4]+0.004*[# 10]+0.004*[# 11]+0.004*[# 12]+0.004*[# 18] + +0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23]+0.004*[# 24] + +0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 6]+0.004*[# 8] + +0.004*[# 14]+0.004*[# 15]+0.004*[# 31]+0.004*[# 32]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.808 +==== e( 3) = -3.08338 eV ==== + psi = 0.113*[# 5]+0.113*[# 13]+0.113*[# 29]+0.084*[# 9]+0.084*[# 17] + +0.084*[# 21]+0.084*[# 25]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14] + +0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.019*[# 10]+0.019*[# 11] + +0.019*[# 12]+0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22] + +0.019*[# 23]+0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28] + +0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.005*[# 2]+0.005*[# 3] + +0.005*[# 4] + |psi|^2 = 1.121 +==== e( 4) = -3.08238 eV ==== + psi = 0.169*[# 1]+0.084*[# 9]+0.084*[# 17]+0.084*[# 21]+0.084*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15] + +0.011*[# 31]+0.011*[# 32]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12] + +0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23] + +0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.005*[# 7] + +0.005*[# 16]+0.005*[# 30] + |psi|^2 = 0.935 +==== e( 5) = -0.06735 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.060*[# 9]+0.060*[# 17] + +0.060*[# 21]+0.060*[# 25]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + +0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19] + +0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26] + +0.021*[# 27]+0.021*[# 28]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 16]+0.018*[# 30]+0.018*[# 31] + +0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.06705 eV ==== + psi = 0.121*[# 1]+0.060*[# 9]+0.060*[# 17]+0.060*[# 21]+0.060*[# 25] + +0.048*[# 7]+0.048*[# 16]+0.048*[# 30]+0.040*[# 5]+0.040*[# 13] + +0.040*[# 29]+0.036*[# 2]+0.036*[# 3]+0.036*[# 4]+0.030*[# 10] + +0.030*[# 11]+0.030*[# 12]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 1.211 +==== e( 7) = 1.46284 eV ==== + psi = 0.102*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.019*[# 7] + +0.019*[# 16]+0.019*[# 30]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.011*[# 2] + +0.011*[# 3]+0.011*[# 4] + |psi|^2 = 0.832 +==== e( 8) = 1.46285 eV ==== + psi = 0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.039*[# 6]+0.039*[# 8]+0.039*[# 14] + +0.039*[# 15]+0.039*[# 31]+0.039*[# 32]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.019*[# 2]+0.019*[# 3]+0.019*[# 4]+0.011*[# 7]+0.011*[# 16] + +0.011*[# 30] + |psi|^2 = 1.050 +==== e( 9) = 1.95717 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 1.95751 eV ==== + psi = 0.065*[# 6]+0.065*[# 8]+0.065*[# 14]+0.065*[# 15]+0.065*[# 31] + +0.065*[# 32]+0.046*[# 10]+0.046*[# 11]+0.046*[# 12]+0.046*[# 18] + +0.046*[# 19]+0.046*[# 20]+0.046*[# 22]+0.046*[# 23]+0.046*[# 24] + +0.046*[# 26]+0.046*[# 27]+0.046*[# 28]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.018*[# 7]+0.018*[# 16]+0.018*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 1.159 +==== e( 11) = 3.02286 eV ==== + psi = 0.065*[# 7]+0.065*[# 16]+0.065*[# 30]+0.045*[# 2]+0.045*[# 3] + +0.045*[# 4]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.020*[# 1] + +0.010*[# 9]+0.010*[# 17]+0.010*[# 21]+0.010*[# 25]+0.007*[# 5] + +0.007*[# 13]+0.007*[# 29] + |psi|^2 = 1.115 +==== e( 12) = 3.02323 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.058*[# 7]+0.058*[# 16] + +0.058*[# 30]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 18] + +0.050*[# 19]+0.050*[# 20]+0.050*[# 22]+0.050*[# 23]+0.050*[# 24] + +0.050*[# 26]+0.050*[# 27]+0.050*[# 28]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.013*[# 5] + +0.013*[# 13]+0.013*[# 29]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25] + |psi|^2 = 1.281 +==== e( 13) = 4.06622 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 4.06644 eV ==== + psi = 0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.025*[# 10]+0.025*[# 11] + +0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20]+0.025*[# 22] + +0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27]+0.025*[# 28] + +0.022*[# 6]+0.022*[# 8]+0.022*[# 14]+0.022*[# 15]+0.022*[# 31] + +0.022*[# 32]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.623 +==== e( 15) = 4.88257 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.040*[# 7]+0.040*[# 16] + +0.040*[# 30]+0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 1.023 +==== e( 16) = 4.88277 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20] + +0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27] + +0.027*[# 28]+0.007*[# 7]+0.007*[# 16]+0.007*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.656 + + k = 0.1666666667 0.6666666667 0.5000000000 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.005*[# 10]+0.005*[# 11]+0.005*[# 12]+0.005*[# 18] + +0.005*[# 19]+0.005*[# 20]+0.005*[# 22]+0.005*[# 23]+0.005*[# 24] + +0.005*[# 26]+0.005*[# 27]+0.005*[# 28]+0.005*[# 6]+0.005*[# 8] + +0.005*[# 14]+0.005*[# 15]+0.005*[# 31]+0.005*[# 32]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 0.836 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14] + +0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.017*[# 10]+0.017*[# 11] + +0.017*[# 12]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20]+0.017*[# 22] + +0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27]+0.017*[# 28] + +0.012*[# 7]+0.012*[# 16]+0.012*[# 30]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 1.118 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.012*[# 2]+0.012*[# 3] + +0.012*[# 4]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15] + +0.011*[# 31]+0.011*[# 32]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12] + +0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23] + +0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.009*[# 7] + +0.009*[# 16]+0.009*[# 30] + |psi|^2 = 0.960 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.038*[# 2]+0.038*[# 3] + +0.038*[# 4]+0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15] + +0.032*[# 31]+0.032*[# 32]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.021*[# 7] + +0.021*[# 16]+0.021*[# 30] + |psi|^2 = 1.123 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.036*[# 7]+0.036*[# 16]+0.036*[# 30] + +0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.019*[# 1]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.930 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.044*[# 9] + +0.044*[# 17]+0.044*[# 21]+0.044*[# 25]+0.035*[# 5]+0.035*[# 13] + +0.035*[# 29]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.015*[# 7] + +0.015*[# 16]+0.015*[# 30] + |psi|^2 = 1.062 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.063*[# 6]+0.063*[# 8]+0.063*[# 14]+0.063*[# 15]+0.063*[# 31] + +0.063*[# 32]+0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.029*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.010*[# 5]+0.010*[# 13]+0.010*[# 29]+0.008*[# 7] + +0.008*[# 16]+0.008*[# 30] + |psi|^2 = 1.225 +==== e( 11) = 3.70118 eV ==== + psi = 0.057*[# 7]+0.057*[# 16]+0.057*[# 30]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.031*[# 6]+0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31] + +0.031*[# 32]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.967 +==== e( 12) = 3.70168 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.045*[# 10]+0.045*[# 11] + +0.045*[# 12]+0.045*[# 18]+0.045*[# 19]+0.045*[# 20]+0.045*[# 22] + +0.045*[# 23]+0.045*[# 24]+0.045*[# 26]+0.045*[# 27]+0.045*[# 28] + +0.045*[# 7]+0.045*[# 16]+0.045*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.028*[# 1] + +0.014*[# 9]+0.014*[# 17]+0.014*[# 21]+0.014*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 1.199 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.025*[# 10]+0.025*[# 11] + +0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20]+0.025*[# 22] + +0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27]+0.025*[# 28] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30]+0.002*[# 1] + + |psi|^2 = 0.608 +==== e( 15) = 4.84656 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.012*[# 2]+0.012*[# 3]+0.012*[# 4]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 1.118 +==== e( 16) = 4.84692 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.030*[# 10] + +0.030*[# 11]+0.030*[# 12]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.007*[# 7]+0.007*[# 16]+0.007*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.737 + + k = 0.3333333333 0.6666666667 0.5000000000 +==== e( 1) = -3.94104 eV ==== + psi = 0.122*[# 5]+0.122*[# 13]+0.122*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.94002 eV ==== + psi = 0.182*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.061*[# 5]+0.061*[# 13]+0.061*[# 29]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15] + +0.008*[# 31]+0.008*[# 32]+0.007*[# 10]+0.007*[# 11]+0.007*[# 12] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.910 +==== e( 3) = -3.23789 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.094*[# 9]+0.094*[# 17] + +0.094*[# 21]+0.094*[# 25]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14] + +0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.014*[# 10]+0.014*[# 11] + +0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22] + +0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28] + +0.012*[# 2]+0.012*[# 3]+0.012*[# 4]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 1.086 +==== e( 4) = -3.23693 eV ==== + psi = 0.189*[# 1]+0.094*[# 9]+0.094*[# 17]+0.094*[# 21]+0.094*[# 25] + +0.063*[# 5]+0.063*[# 13]+0.063*[# 29]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 14]+0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.008*[# 2] + +0.008*[# 3]+0.008*[# 4] + |psi|^2 = 1.001 +==== e( 5) = -0.73636 eV ==== + psi = 0.073*[# 1]+0.058*[# 7]+0.058*[# 16]+0.058*[# 30]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.024*[# 5]+0.024*[# 13]+0.024*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.018*[# 2] + +0.018*[# 3]+0.018*[# 4] + |psi|^2 = 0.989 +==== e( 6) = -0.73621 eV ==== + psi = 0.048*[# 5]+0.048*[# 13]+0.048*[# 29]+0.040*[# 2]+0.040*[# 3] + +0.040*[# 4]+0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 31]+0.040*[# 32]+0.036*[# 9]+0.036*[# 17]+0.036*[# 21] + +0.036*[# 25]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28] + |psi|^2 = 1.015 +==== e( 7) = 0.03076 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.039*[# 9]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.038*[# 6]+0.038*[# 8]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 31]+0.038*[# 32]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.016*[# 1]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.997 +==== e( 8) = 0.03135 eV ==== + psi = 0.062*[# 1]+0.057*[# 2]+0.057*[# 3]+0.057*[# 4]+0.039*[# 9] + +0.039*[# 17]+0.039*[# 21]+0.039*[# 25]+0.031*[# 5]+0.031*[# 13] + +0.031*[# 29]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.022*[# 7]+0.022*[# 16] + +0.022*[# 30]+0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.023 +==== e( 9) = 3.53934 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.990 +==== e( 10) = 3.54036 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.061*[# 6]+0.061*[# 8] + +0.061*[# 14]+0.061*[# 15]+0.061*[# 31]+0.061*[# 32]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.035*[# 1]+0.017*[# 9]+0.017*[# 17]+0.017*[# 21] + +0.017*[# 25]+0.012*[# 5]+0.012*[# 13]+0.012*[# 29]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 1.253 +==== e( 11) = 4.50427 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22] + +0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + +0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15]+0.018*[# 31] + +0.018*[# 32]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + |psi|^2 = 0.531 +==== e( 12) = 4.50435 eV ==== + psi = 0.059*[# 7]+0.059*[# 16]+0.059*[# 30]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 18] + +0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24] + +0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.793 +==== e( 13) = 4.57402 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.024*[# 1]+0.017*[# 2] + +0.017*[# 3]+0.017*[# 4]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29] + |psi|^2 = 0.987 +==== e( 14) = 4.57418 eV ==== + psi = 0.023*[# 7]+0.023*[# 16]+0.023*[# 30]+0.019*[# 10]+0.019*[# 11] + +0.019*[# 12]+0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22] + +0.019*[# 23]+0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.016*[# 5] + +0.016*[# 13]+0.016*[# 29]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25] + |psi|^2 = 0.560 +==== e( 15) = 4.74870 eV ==== + psi = 0.128*[# 7]+0.128*[# 16]+0.128*[# 30]+0.065*[# 10]+0.065*[# 11] + +0.065*[# 12]+0.065*[# 18]+0.065*[# 19]+0.065*[# 20]+0.065*[# 22] + +0.065*[# 23]+0.065*[# 24]+0.065*[# 26]+0.065*[# 27]+0.065*[# 28] + +0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32] + |psi|^2 = 1.569 +==== e( 16) = 4.74983 eV ==== + psi = 0.088*[# 2]+0.088*[# 3]+0.088*[# 4]+0.049*[# 6]+0.049*[# 8] + +0.049*[# 14]+0.049*[# 15]+0.049*[# 31]+0.049*[# 32]+0.048*[# 10] + +0.048*[# 11]+0.048*[# 12]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.005*[# 7]+0.005*[# 16]+0.005*[# 30] + |psi|^2 = 1.142 + + k = 0.5000000000 0.6666666667 0.5000000000 +==== e( 1) = -3.56633 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.009*[# 2]+0.009*[# 3]+0.009*[# 4] + +0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15]+0.007*[# 31] + +0.007*[# 32] + |psi|^2 = 0.995 +==== e( 2) = -3.56624 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14] + +0.015*[# 15]+0.015*[# 31]+0.015*[# 32]+0.010*[# 10]+0.010*[# 11] + +0.010*[# 12]+0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22] + +0.010*[# 23]+0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28] + +0.007*[# 7]+0.007*[# 16]+0.007*[# 30]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4] + |psi|^2 = 0.995 +==== e( 3) = -3.56624 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.995 +==== e( 4) = -3.56434 eV ==== + psi = 0.377*[# 1]+0.095*[# 9]+0.095*[# 17]+0.095*[# 21]+0.095*[# 25] + +0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 31] + +0.010*[# 32]+0.004*[# 2]+0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.995 +==== e( 5) = -0.56737 eV ==== + psi = 0.107*[# 7]+0.107*[# 16]+0.107*[# 30]+0.058*[# 1]+0.035*[# 9] + +0.035*[# 17]+0.035*[# 21]+0.035*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.028*[# 5]+0.028*[# 13]+0.028*[# 29]+0.005*[# 2]+0.005*[# 3] + +0.005*[# 4]+0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.988 +==== e( 6) = -0.56683 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.044*[# 6]+0.044*[# 8] + +0.044*[# 14]+0.044*[# 15]+0.044*[# 31]+0.044*[# 32]+0.035*[# 9] + +0.035*[# 17]+0.035*[# 21]+0.035*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.002*[# 7]+0.002*[# 16] + +0.002*[# 30] + |psi|^2 = 0.988 +==== e( 7) = -0.56683 eV ==== + psi = 0.049*[# 6]+0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 31] + +0.049*[# 32]+0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.035*[# 9] + +0.035*[# 17]+0.035*[# 21]+0.035*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.019*[# 2]+0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.988 +==== e( 8) = -0.56653 eV ==== + psi = 0.084*[# 1]+0.066*[# 2]+0.066*[# 3]+0.066*[# 4]+0.035*[# 9] + +0.035*[# 17]+0.035*[# 21]+0.035*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.022*[# 6]+0.022*[# 8]+0.022*[# 14]+0.022*[# 15]+0.022*[# 31] + +0.022*[# 32]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.007*[# 7] + +0.007*[# 16]+0.007*[# 30] + |psi|^2 = 0.988 +==== e( 9) = 4.26946 eV ==== + psi = 0.142*[# 7]+0.142*[# 16]+0.142*[# 30]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.015*[# 5]+0.015*[# 13]+0.015*[# 29]+0.011*[# 9]+0.011*[# 17] + +0.011*[# 21]+0.011*[# 25]+0.003*[# 6]+0.003*[# 8]+0.003*[# 14] + +0.003*[# 15]+0.003*[# 31]+0.003*[# 32]+0.001*[# 2]+0.001*[# 3] + +0.001*[# 4] + |psi|^2 = 0.988 +==== e( 10) = 4.27017 eV ==== + psi = 0.069*[# 6]+0.069*[# 8]+0.069*[# 14]+0.069*[# 15]+0.069*[# 31] + +0.069*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.015*[# 5]+0.015*[# 13] + +0.015*[# 29]+0.011*[# 9]+0.011*[# 17]+0.011*[# 21]+0.011*[# 25] + +0.008*[# 2]+0.008*[# 3]+0.008*[# 4]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.988 +==== e( 11) = 4.27017 eV ==== + psi = 0.054*[# 6]+0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31] + +0.054*[# 32]+0.042*[# 2]+0.042*[# 3]+0.042*[# 4]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.015*[# 5]+0.015*[# 13]+0.015*[# 29]+0.011*[# 9] + +0.011*[# 17]+0.011*[# 21]+0.011*[# 25] + |psi|^2 = 0.987 +==== e( 12) = 4.27105 eV ==== + psi = 0.098*[# 2]+0.098*[# 3]+0.098*[# 4]+0.046*[# 1]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15] + +0.023*[# 31]+0.023*[# 32]+0.011*[# 9]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.004*[# 7]+0.004*[# 16]+0.004*[# 30] + |psi|^2 = 0.988 +==== e( 13) = 4.92638 eV ==== + psi = 0.164*[# 7]+0.164*[# 16]+0.164*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.988 +==== e( 14) = 4.92678 eV ==== + psi = 0.082*[# 6]+0.082*[# 8]+0.082*[# 14]+0.082*[# 15]+0.082*[# 31] + +0.082*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + |psi|^2 = 0.988 +==== e( 15) = 4.92770 eV ==== + psi = 0.065*[# 6]+0.065*[# 8]+0.065*[# 14]+0.065*[# 15]+0.065*[# 31] + +0.065*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4] + |psi|^2 = 0.988 +==== e( 16) = 4.92770 eV ==== + psi = 0.082*[# 7]+0.082*[# 16]+0.082*[# 30]+0.048*[# 2]+0.048*[# 3] + +0.048*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.017*[# 6]+0.017*[# 8] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 31]+0.017*[# 32] + |psi|^2 = 0.988 + + k = 0.6666666667 0.6666666667 0.5000000000 +==== e( 1) = -3.94104 eV ==== + psi = 0.122*[# 5]+0.122*[# 13]+0.122*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.94002 eV ==== + psi = 0.182*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.061*[# 5]+0.061*[# 13]+0.061*[# 29]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15] + +0.008*[# 31]+0.008*[# 32]+0.007*[# 10]+0.007*[# 11]+0.007*[# 12] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.910 +==== e( 3) = -3.23789 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.094*[# 9]+0.094*[# 17] + +0.094*[# 21]+0.094*[# 25]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14] + +0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.014*[# 10]+0.014*[# 11] + +0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22] + +0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28] + +0.012*[# 2]+0.012*[# 3]+0.012*[# 4]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 1.086 +==== e( 4) = -3.23693 eV ==== + psi = 0.189*[# 1]+0.094*[# 9]+0.094*[# 17]+0.094*[# 21]+0.094*[# 25] + +0.063*[# 5]+0.063*[# 13]+0.063*[# 29]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 14]+0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.008*[# 2] + +0.008*[# 3]+0.008*[# 4] + |psi|^2 = 1.001 +==== e( 5) = -0.73636 eV ==== + psi = 0.073*[# 1]+0.058*[# 7]+0.058*[# 16]+0.058*[# 30]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.024*[# 5]+0.024*[# 13]+0.024*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.018*[# 2] + +0.018*[# 3]+0.018*[# 4] + |psi|^2 = 0.989 +==== e( 6) = -0.73621 eV ==== + psi = 0.048*[# 5]+0.048*[# 13]+0.048*[# 29]+0.040*[# 2]+0.040*[# 3] + +0.040*[# 4]+0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 31]+0.040*[# 32]+0.036*[# 9]+0.036*[# 17]+0.036*[# 21] + +0.036*[# 25]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28] + |psi|^2 = 1.015 +==== e( 7) = 0.03076 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.039*[# 9]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.038*[# 6]+0.038*[# 8]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 31]+0.038*[# 32]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.016*[# 1]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.997 +==== e( 8) = 0.03135 eV ==== + psi = 0.062*[# 1]+0.057*[# 2]+0.057*[# 3]+0.057*[# 4]+0.039*[# 9] + +0.039*[# 17]+0.039*[# 21]+0.039*[# 25]+0.031*[# 5]+0.031*[# 13] + +0.031*[# 29]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.022*[# 7]+0.022*[# 16] + +0.022*[# 30]+0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.023 +==== e( 9) = 3.53934 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.990 +==== e( 10) = 3.54036 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.061*[# 6]+0.061*[# 8] + +0.061*[# 14]+0.061*[# 15]+0.061*[# 31]+0.061*[# 32]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.035*[# 1]+0.017*[# 9]+0.017*[# 17]+0.017*[# 21] + +0.017*[# 25]+0.012*[# 5]+0.012*[# 13]+0.012*[# 29]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 1.253 +==== e( 11) = 4.50427 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22] + +0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + +0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15]+0.018*[# 31] + +0.018*[# 32]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + |psi|^2 = 0.531 +==== e( 12) = 4.50435 eV ==== + psi = 0.059*[# 7]+0.059*[# 16]+0.059*[# 30]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 18] + +0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24] + +0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.793 +==== e( 13) = 4.57402 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.024*[# 1]+0.017*[# 2] + +0.017*[# 3]+0.017*[# 4]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29] + |psi|^2 = 0.987 +==== e( 14) = 4.57418 eV ==== + psi = 0.023*[# 7]+0.023*[# 16]+0.023*[# 30]+0.019*[# 10]+0.019*[# 11] + +0.019*[# 12]+0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22] + +0.019*[# 23]+0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.016*[# 5] + +0.016*[# 13]+0.016*[# 29]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25] + |psi|^2 = 0.560 +==== e( 15) = 4.74870 eV ==== + psi = 0.128*[# 7]+0.128*[# 16]+0.128*[# 30]+0.065*[# 10]+0.065*[# 11] + +0.065*[# 12]+0.065*[# 18]+0.065*[# 19]+0.065*[# 20]+0.065*[# 22] + +0.065*[# 23]+0.065*[# 24]+0.065*[# 26]+0.065*[# 27]+0.065*[# 28] + +0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32] + |psi|^2 = 1.569 +==== e( 16) = 4.74983 eV ==== + psi = 0.088*[# 2]+0.088*[# 3]+0.088*[# 4]+0.049*[# 6]+0.049*[# 8] + +0.049*[# 14]+0.049*[# 15]+0.049*[# 31]+0.049*[# 32]+0.048*[# 10] + +0.048*[# 11]+0.048*[# 12]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.005*[# 7]+0.005*[# 16]+0.005*[# 30] + |psi|^2 = 1.142 + + k = 0.8333333333 0.6666666667 0.5000000000 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.005*[# 10]+0.005*[# 11]+0.005*[# 12]+0.005*[# 18] + +0.005*[# 19]+0.005*[# 20]+0.005*[# 22]+0.005*[# 23]+0.005*[# 24] + +0.005*[# 26]+0.005*[# 27]+0.005*[# 28]+0.005*[# 6]+0.005*[# 8] + +0.005*[# 14]+0.005*[# 15]+0.005*[# 31]+0.005*[# 32]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 0.836 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14] + +0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.017*[# 10]+0.017*[# 11] + +0.017*[# 12]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20]+0.017*[# 22] + +0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27]+0.017*[# 28] + +0.012*[# 7]+0.012*[# 16]+0.012*[# 30]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 1.118 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.012*[# 2]+0.012*[# 3] + +0.012*[# 4]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15] + +0.011*[# 31]+0.011*[# 32]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12] + +0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23] + +0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.009*[# 7] + +0.009*[# 16]+0.009*[# 30] + |psi|^2 = 0.960 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.038*[# 2]+0.038*[# 3] + +0.038*[# 4]+0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15] + +0.032*[# 31]+0.032*[# 32]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.021*[# 7] + +0.021*[# 16]+0.021*[# 30] + |psi|^2 = 1.123 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.036*[# 7]+0.036*[# 16]+0.036*[# 30] + +0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.019*[# 1]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.930 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.044*[# 9] + +0.044*[# 17]+0.044*[# 21]+0.044*[# 25]+0.035*[# 5]+0.035*[# 13] + +0.035*[# 29]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.015*[# 7] + +0.015*[# 16]+0.015*[# 30] + |psi|^2 = 1.062 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.063*[# 6]+0.063*[# 8]+0.063*[# 14]+0.063*[# 15]+0.063*[# 31] + +0.063*[# 32]+0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.029*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.010*[# 5]+0.010*[# 13]+0.010*[# 29]+0.008*[# 7] + +0.008*[# 16]+0.008*[# 30] + |psi|^2 = 1.225 +==== e( 11) = 3.70118 eV ==== + psi = 0.057*[# 7]+0.057*[# 16]+0.057*[# 30]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.031*[# 6]+0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31] + +0.031*[# 32]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.967 +==== e( 12) = 3.70168 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.045*[# 10]+0.045*[# 11] + +0.045*[# 12]+0.045*[# 18]+0.045*[# 19]+0.045*[# 20]+0.045*[# 22] + +0.045*[# 23]+0.045*[# 24]+0.045*[# 26]+0.045*[# 27]+0.045*[# 28] + +0.045*[# 7]+0.045*[# 16]+0.045*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.028*[# 1] + +0.014*[# 9]+0.014*[# 17]+0.014*[# 21]+0.014*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 1.199 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.025*[# 10]+0.025*[# 11] + +0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20]+0.025*[# 22] + +0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27]+0.025*[# 28] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30]+0.002*[# 1] + + |psi|^2 = 0.608 +==== e( 15) = 4.84656 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.012*[# 2]+0.012*[# 3]+0.012*[# 4]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 1.118 +==== e( 16) = 4.84692 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.030*[# 10] + +0.030*[# 11]+0.030*[# 12]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.007*[# 7]+0.007*[# 16]+0.007*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.737 + + k = 0.0000000000 0.8333333333 0.5000000000 +==== e( 1) = -4.63271 eV ==== + psi = 0.120*[# 5]+0.120*[# 13]+0.120*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.001*[# 6]+0.001*[# 8]+0.001*[# 14]+0.001*[# 15]+0.001*[# 31] + +0.001*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.63166 eV ==== + psi = 0.180*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.001*[# 10]+0.001*[# 11]+0.001*[# 12]+0.001*[# 18] + +0.001*[# 19]+0.001*[# 20]+0.001*[# 22]+0.001*[# 23]+0.001*[# 24] + +0.001*[# 26]+0.001*[# 27]+0.001*[# 28]+0.001*[# 6]+0.001*[# 8] + +0.001*[# 14]+0.001*[# 15]+0.001*[# 31]+0.001*[# 32] + |psi|^2 = 0.748 +==== e( 3) = -2.29294 eV ==== + psi = 0.110*[# 5]+0.110*[# 13]+0.110*[# 29]+0.082*[# 9]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.034*[# 6]+0.034*[# 8]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.024*[# 10]+0.024*[# 11] + +0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22] + +0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28] + +0.017*[# 7]+0.017*[# 16]+0.017*[# 30]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4] + |psi|^2 = 1.222 +==== e( 4) = -2.29202 eV ==== + psi = 0.164*[# 1]+0.082*[# 9]+0.082*[# 17]+0.082*[# 21]+0.082*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.017*[# 2]+0.017*[# 3] + +0.017*[# 4]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.010*[# 7] + +0.010*[# 16]+0.010*[# 30] + |psi|^2 = 0.977 +==== e( 5) = -0.76680 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19] + +0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26] + +0.018*[# 27]+0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.994 +==== e( 6) = -0.76629 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.043*[# 7]+0.043*[# 16] + +0.043*[# 30]+0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.028*[# 10] + +0.028*[# 11]+0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32] + |psi|^2 = 1.229 +==== e( 7) = 1.89706 eV ==== + psi = 0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.028*[# 10] + +0.028*[# 11]+0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.003*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.674 +==== e( 8) = 1.89734 eV ==== + psi = 0.048*[# 6]+0.048*[# 8]+0.048*[# 14]+0.048*[# 15]+0.048*[# 31] + +0.048*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.909 +==== e( 9) = 2.23554 eV ==== + psi = 0.103*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15]+0.040*[# 31] + +0.040*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.987 +==== e( 10) = 2.23572 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.013*[# 10]+0.013*[# 11] + +0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22] + +0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28] + +0.010*[# 2]+0.010*[# 3]+0.010*[# 4]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.717 +==== e( 11) = 3.04468 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.048*[# 2]+0.048*[# 3] + +0.048*[# 4]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.971 +==== e( 12) = 3.04476 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.026*[# 7]+0.026*[# 16]+0.026*[# 30]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.002*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.701 +==== e( 13) = 3.80535 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.989 +==== e( 14) = 3.80571 eV ==== + psi = 0.082*[# 6]+0.082*[# 8]+0.082*[# 14]+0.082*[# 15]+0.082*[# 31] + +0.082*[# 32]+0.059*[# 10]+0.059*[# 11]+0.059*[# 12]+0.059*[# 18] + +0.059*[# 19]+0.059*[# 20]+0.059*[# 22]+0.059*[# 23]+0.059*[# 24] + +0.059*[# 26]+0.059*[# 27]+0.059*[# 28]+0.046*[# 2]+0.046*[# 3] + +0.046*[# 4]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 1.459 +==== e( 15) = 4.52337 eV ==== + psi = 0.050*[# 7]+0.050*[# 16]+0.050*[# 30]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.871 +==== e( 16) = 4.52360 eV ==== + psi = 0.089*[# 2]+0.089*[# 3]+0.089*[# 4]+0.066*[# 7]+0.066*[# 16] + +0.066*[# 30]+0.055*[# 10]+0.055*[# 11]+0.055*[# 12]+0.055*[# 18] + +0.055*[# 19]+0.055*[# 20]+0.055*[# 22]+0.055*[# 23]+0.055*[# 24] + +0.055*[# 26]+0.055*[# 27]+0.055*[# 28]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.006*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 1.340 + + k = 0.1666666667 0.8333333333 0.5000000000 +==== e( 1) = -4.52498 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.52394 eV ==== + psi = 0.179*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 8]+0.003*[# 14]+0.003*[# 15] + +0.003*[# 31]+0.003*[# 32]+0.003*[# 10]+0.003*[# 11]+0.003*[# 12] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28] + |psi|^2 = 0.785 +==== e( 3) = -2.53521 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.031*[# 6]+0.031*[# 8]+0.031*[# 14] + +0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22] + +0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + +0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 1.203 +==== e( 4) = -2.53429 eV ==== + psi = 0.172*[# 1]+0.086*[# 9]+0.086*[# 17]+0.086*[# 21]+0.086*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.013*[# 7]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 16]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22] + +0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28] + +0.013*[# 30]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.995 +==== e( 5) = -0.69955 eV ==== + psi = 0.078*[# 5]+0.078*[# 13]+0.078*[# 29]+0.059*[# 9]+0.059*[# 17] + +0.059*[# 21]+0.059*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.69934 eV ==== + psi = 0.117*[# 1]+0.059*[# 9]+0.059*[# 17]+0.059*[# 21]+0.059*[# 25] + +0.047*[# 7]+0.047*[# 16]+0.047*[# 30]+0.039*[# 5]+0.039*[# 13] + +0.039*[# 29]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.129 +==== e( 7) = 1.70960 eV ==== + psi = 0.051*[# 5]+0.051*[# 13]+0.051*[# 29]+0.046*[# 9]+0.046*[# 17] + +0.046*[# 21]+0.046*[# 25]+0.036*[# 7]+0.036*[# 16]+0.036*[# 30] + +0.029*[# 1]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18] + +0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24] + +0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.014*[# 6]+0.014*[# 8] + +0.014*[# 14]+0.014*[# 15]+0.014*[# 31]+0.014*[# 32]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.796 +==== e( 8) = 1.71009 eV ==== + psi = 0.062*[# 1]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.030*[# 6]+0.030*[# 8]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 31]+0.030*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 0.933 +==== e( 9) = 2.10371 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.10436 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 6]+0.049*[# 8] + +0.049*[# 14]+0.049*[# 15]+0.049*[# 31]+0.049*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.017*[# 1]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + +0.009*[# 9]+0.009*[# 17]+0.009*[# 21]+0.009*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 1.048 +==== e( 11) = 3.36740 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.039*[# 7]+0.039*[# 16] + +0.039*[# 30]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 18] + +0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23]+0.034*[# 24] + +0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32] + |psi|^2 = 0.828 +==== e( 12) = 3.36742 eV ==== + psi = 0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.039*[# 2]+0.039*[# 3] + +0.039*[# 4]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.883 +==== e( 13) = 4.14946 eV ==== + psi = 0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.028*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.988 +==== e( 14) = 4.14988 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 8] + +0.038*[# 14]+0.038*[# 15]+0.038*[# 31]+0.038*[# 32]+0.029*[# 10] + +0.029*[# 11]+0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.002*[# 1]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.820 +==== e( 15) = 4.40345 eV ==== + psi = 0.110*[# 7]+0.110*[# 16]+0.110*[# 30]+0.058*[# 10]+0.058*[# 11] + +0.058*[# 12]+0.058*[# 18]+0.058*[# 19]+0.058*[# 20]+0.058*[# 22] + +0.058*[# 23]+0.058*[# 24]+0.058*[# 26]+0.058*[# 27]+0.058*[# 28] + +0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + |psi|^2 = 1.390 +==== e( 16) = 4.40456 eV ==== + psi = 0.101*[# 2]+0.101*[# 3]+0.101*[# 4]+0.051*[# 10]+0.051*[# 11] + +0.051*[# 12]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20]+0.051*[# 22] + +0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27]+0.051*[# 28] + +0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30] + |psi|^2 = 1.223 + + k = 0.3333333333 0.8333333333 0.5000000000 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.009*[# 6]+0.009*[# 8] + +0.009*[# 14]+0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 18]+0.007*[# 19]+0.007*[# 20] + +0.007*[# 22]+0.007*[# 23]+0.007*[# 24]+0.007*[# 26]+0.007*[# 27] + +0.007*[# 28]+0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.880 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14] + +0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.017*[# 10]+0.017*[# 11] + +0.017*[# 12]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20]+0.017*[# 22] + +0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27]+0.017*[# 28] + +0.012*[# 7]+0.012*[# 16]+0.012*[# 30]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 1.118 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.017*[# 2]+0.017*[# 3] + +0.017*[# 4]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 1.004 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.028*[# 2] + +0.028*[# 3]+0.028*[# 4]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.026 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.036*[# 7]+0.036*[# 16]+0.036*[# 30] + +0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.019*[# 1]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.930 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.044*[# 9] + +0.044*[# 17]+0.044*[# 21]+0.044*[# 25]+0.035*[# 5]+0.035*[# 13] + +0.035*[# 29]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 18] + +0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24] + +0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.016*[# 7] + +0.016*[# 16]+0.016*[# 30] + |psi|^2 = 0.965 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.038*[# 10] + +0.038*[# 11]+0.038*[# 12]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.029*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 1.021 +==== e( 11) = 3.70118 eV ==== + psi = 0.057*[# 7]+0.057*[# 16]+0.057*[# 30]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.031*[# 6]+0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31] + +0.031*[# 32]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.967 +==== e( 12) = 3.70168 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.028*[# 1]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30] + +0.014*[# 9]+0.014*[# 17]+0.014*[# 21]+0.014*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.995 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.054*[# 6]+0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31] + +0.054*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.002*[# 1] + + |psi|^2 = 0.921 +==== e( 15) = 4.84656 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.012*[# 2]+0.012*[# 3]+0.012*[# 4]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 1.118 +==== e( 16) = 4.84692 eV ==== + psi = 0.078*[# 2]+0.078*[# 3]+0.078*[# 4]+0.043*[# 10]+0.043*[# 11] + +0.043*[# 12]+0.043*[# 18]+0.043*[# 19]+0.043*[# 20]+0.043*[# 22] + +0.043*[# 23]+0.043*[# 24]+0.043*[# 26]+0.043*[# 27]+0.043*[# 28] + +0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.050 + + k = 0.5000000000 0.8333333333 0.5000000000 +==== e( 1) = -3.71242 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19] + +0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26] + +0.012*[# 27]+0.012*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.71222 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14] + +0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 2]+0.004*[# 3]+0.004*[# 4]+0.002*[# 7]+0.002*[# 16] + +0.002*[# 30] + |psi|^2 = 0.994 +==== e( 3) = -3.71222 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.033*[# 2]+0.033*[# 3]+0.033*[# 4] + +0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19] + +0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26] + +0.012*[# 27]+0.012*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -3.71037 eV ==== + psi = 0.353*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15]+0.018*[# 31] + +0.018*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30]+0.005*[# 2]+0.005*[# 3]+0.005*[# 4] + |psi|^2 = 0.994 +==== e( 5) = 0.12722 eV ==== + psi = 0.098*[# 7]+0.098*[# 16]+0.098*[# 30]+0.045*[# 5]+0.045*[# 13] + +0.045*[# 29]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.041*[# 1]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 0.991 +==== e( 6) = 0.12772 eV ==== + psi = 0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.049*[# 6]+0.049*[# 8] + +0.049*[# 14]+0.049*[# 15]+0.049*[# 31]+0.049*[# 32]+0.044*[# 9] + +0.044*[# 17]+0.044*[# 21]+0.044*[# 25]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.008*[# 2]+0.008*[# 3]+0.008*[# 4] + |psi|^2 = 0.991 +==== e( 7) = 0.12772 eV ==== + psi = 0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.042*[# 2]+0.042*[# 3]+0.042*[# 4] + +0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + |psi|^2 = 0.991 +==== e( 8) = 0.12828 eV ==== + psi = 0.135*[# 1]+0.047*[# 2]+0.047*[# 3]+0.047*[# 4]+0.044*[# 9] + +0.044*[# 17]+0.044*[# 21]+0.044*[# 25]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.014*[# 5]+0.014*[# 13]+0.014*[# 29]+0.008*[# 7] + +0.008*[# 16]+0.008*[# 30] + |psi|^2 = 0.991 +==== e( 9) = 3.08095 eV ==== + psi = 0.122*[# 7]+0.122*[# 16]+0.122*[# 30]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.020*[# 5]+0.020*[# 13]+0.020*[# 29]+0.016*[# 9]+0.016*[# 17] + +0.016*[# 21]+0.016*[# 25]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14] + +0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.001*[# 1] + |psi|^2 = 0.991 +==== e( 10) = 3.08168 eV ==== + psi = 0.055*[# 6]+0.055*[# 8]+0.055*[# 14]+0.055*[# 15]+0.055*[# 31] + +0.055*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.025*[# 2]+0.025*[# 3] + +0.025*[# 4]+0.021*[# 5]+0.021*[# 13]+0.021*[# 29]+0.016*[# 9] + +0.016*[# 17]+0.016*[# 21]+0.016*[# 25]+0.010*[# 7]+0.010*[# 16] + +0.010*[# 30] + |psi|^2 = 0.991 +==== e( 11) = 3.08168 eV ==== + psi = 0.065*[# 6]+0.065*[# 8]+0.065*[# 14]+0.065*[# 15]+0.065*[# 31] + +0.065*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.021*[# 5]+0.021*[# 13] + +0.021*[# 29]+0.016*[# 9]+0.016*[# 17]+0.016*[# 21]+0.016*[# 25] + +0.014*[# 2]+0.014*[# 3]+0.014*[# 4] + |psi|^2 = 0.991 +==== e( 12) = 3.08237 eV ==== + psi = 0.103*[# 2]+0.103*[# 3]+0.103*[# 4]+0.061*[# 1]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.016*[# 9]+0.016*[# 17]+0.016*[# 21]+0.016*[# 25] + +0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15]+0.014*[# 31] + +0.014*[# 32]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30] + |psi|^2 = 0.991 +==== e( 13) = 4.86024 eV ==== + psi = 0.164*[# 7]+0.164*[# 16]+0.164*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.988 +==== e( 14) = 4.86071 eV ==== + psi = 0.082*[# 6]+0.082*[# 8]+0.082*[# 14]+0.082*[# 15]+0.082*[# 31] + +0.082*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + |psi|^2 = 0.988 +==== e( 15) = 4.86155 eV ==== + psi = 0.055*[# 6]+0.055*[# 8]+0.055*[# 14]+0.055*[# 15]+0.055*[# 31] + +0.055*[# 32]+0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28] + |psi|^2 = 0.988 +==== e( 16) = 4.86155 eV ==== + psi = 0.082*[# 7]+0.082*[# 16]+0.082*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32] + |psi|^2 = 0.988 + + k = 0.6666666667 0.8333333333 0.5000000000 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.009*[# 6]+0.009*[# 8] + +0.009*[# 14]+0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 18]+0.007*[# 19]+0.007*[# 20] + +0.007*[# 22]+0.007*[# 23]+0.007*[# 24]+0.007*[# 26]+0.007*[# 27] + +0.007*[# 28]+0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.880 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14] + +0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.017*[# 10]+0.017*[# 11] + +0.017*[# 12]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20]+0.017*[# 22] + +0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27]+0.017*[# 28] + +0.012*[# 7]+0.012*[# 16]+0.012*[# 30]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 1.118 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.017*[# 2]+0.017*[# 3] + +0.017*[# 4]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 1.004 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.028*[# 2] + +0.028*[# 3]+0.028*[# 4]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.026 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.036*[# 7]+0.036*[# 16]+0.036*[# 30] + +0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.019*[# 1]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.930 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.044*[# 9] + +0.044*[# 17]+0.044*[# 21]+0.044*[# 25]+0.035*[# 5]+0.035*[# 13] + +0.035*[# 29]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 18] + +0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24] + +0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.016*[# 7] + +0.016*[# 16]+0.016*[# 30] + |psi|^2 = 0.965 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.038*[# 10] + +0.038*[# 11]+0.038*[# 12]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.029*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 1.021 +==== e( 11) = 3.70118 eV ==== + psi = 0.057*[# 7]+0.057*[# 16]+0.057*[# 30]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.031*[# 6]+0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31] + +0.031*[# 32]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.967 +==== e( 12) = 3.70168 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.032*[# 6]+0.032*[# 8]+0.032*[# 14]+0.032*[# 15]+0.032*[# 31] + +0.032*[# 32]+0.028*[# 1]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30] + +0.014*[# 9]+0.014*[# 17]+0.014*[# 21]+0.014*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.995 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.054*[# 6]+0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31] + +0.054*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.002*[# 1] + + |psi|^2 = 0.921 +==== e( 15) = 4.84656 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.012*[# 2]+0.012*[# 3]+0.012*[# 4]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 1.118 +==== e( 16) = 4.84692 eV ==== + psi = 0.078*[# 2]+0.078*[# 3]+0.078*[# 4]+0.043*[# 10]+0.043*[# 11] + +0.043*[# 12]+0.043*[# 18]+0.043*[# 19]+0.043*[# 20]+0.043*[# 22] + +0.043*[# 23]+0.043*[# 24]+0.043*[# 26]+0.043*[# 27]+0.043*[# 28] + +0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.050 + + k = 0.8333333333 0.8333333333 0.5000000000 +==== e( 1) = -4.52498 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.52394 eV ==== + psi = 0.179*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 8]+0.003*[# 14]+0.003*[# 15] + +0.003*[# 31]+0.003*[# 32]+0.003*[# 10]+0.003*[# 11]+0.003*[# 12] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28] + |psi|^2 = 0.785 +==== e( 3) = -2.53521 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.031*[# 6]+0.031*[# 8]+0.031*[# 14] + +0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22] + +0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + +0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 1.203 +==== e( 4) = -2.53429 eV ==== + psi = 0.172*[# 1]+0.086*[# 9]+0.086*[# 17]+0.086*[# 21]+0.086*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.013*[# 7]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 16]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22] + +0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28] + +0.013*[# 30]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.995 +==== e( 5) = -0.69955 eV ==== + psi = 0.078*[# 5]+0.078*[# 13]+0.078*[# 29]+0.059*[# 9]+0.059*[# 17] + +0.059*[# 21]+0.059*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.69934 eV ==== + psi = 0.117*[# 1]+0.059*[# 9]+0.059*[# 17]+0.059*[# 21]+0.059*[# 25] + +0.047*[# 7]+0.047*[# 16]+0.047*[# 30]+0.039*[# 5]+0.039*[# 13] + +0.039*[# 29]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.129 +==== e( 7) = 1.70960 eV ==== + psi = 0.051*[# 5]+0.051*[# 13]+0.051*[# 29]+0.046*[# 9]+0.046*[# 17] + +0.046*[# 21]+0.046*[# 25]+0.036*[# 7]+0.036*[# 16]+0.036*[# 30] + +0.029*[# 1]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18] + +0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24] + +0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.014*[# 6]+0.014*[# 8] + +0.014*[# 14]+0.014*[# 15]+0.014*[# 31]+0.014*[# 32]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.796 +==== e( 8) = 1.71009 eV ==== + psi = 0.062*[# 1]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.030*[# 6]+0.030*[# 8]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 31]+0.030*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 0.933 +==== e( 9) = 2.10371 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.10436 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 6]+0.049*[# 8] + +0.049*[# 14]+0.049*[# 15]+0.049*[# 31]+0.049*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.017*[# 1]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + +0.009*[# 9]+0.009*[# 17]+0.009*[# 21]+0.009*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 1.048 +==== e( 11) = 3.36740 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.039*[# 7]+0.039*[# 16] + +0.039*[# 30]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 18] + +0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23]+0.034*[# 24] + +0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32] + |psi|^2 = 0.828 +==== e( 12) = 3.36742 eV ==== + psi = 0.051*[# 7]+0.051*[# 16]+0.051*[# 30]+0.039*[# 2]+0.039*[# 3] + +0.039*[# 4]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.883 +==== e( 13) = 4.14946 eV ==== + psi = 0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.028*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.988 +==== e( 14) = 4.14988 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 8] + +0.038*[# 14]+0.038*[# 15]+0.038*[# 31]+0.038*[# 32]+0.029*[# 10] + +0.029*[# 11]+0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.002*[# 1]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.820 +==== e( 15) = 4.40345 eV ==== + psi = 0.110*[# 7]+0.110*[# 16]+0.110*[# 30]+0.058*[# 10]+0.058*[# 11] + +0.058*[# 12]+0.058*[# 18]+0.058*[# 19]+0.058*[# 20]+0.058*[# 22] + +0.058*[# 23]+0.058*[# 24]+0.058*[# 26]+0.058*[# 27]+0.058*[# 28] + +0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + |psi|^2 = 1.390 +==== e( 16) = 4.40456 eV ==== + psi = 0.101*[# 2]+0.101*[# 3]+0.101*[# 4]+0.051*[# 10]+0.051*[# 11] + +0.051*[# 12]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20]+0.051*[# 22] + +0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27]+0.051*[# 28] + +0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30] + |psi|^2 = 1.223 + + k = 0.0000000000 0.0000000000 0.6666666667 +==== e( 1) = -5.34348 eV ==== + psi = 0.103*[# 5]+0.103*[# 9]+0.103*[# 13]+0.103*[# 17]+0.103*[# 21] + +0.103*[# 25]+0.103*[# 29]+0.103*[# 1]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4]+0.007*[# 6]+0.007*[# 7]+0.007*[# 8]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 14]+0.007*[# 15]+0.007*[# 16] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.007*[# 30] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.91783 eV ==== + psi = 0.082*[# 1]+0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.082*[# 29] + |psi|^2 = 0.658 +==== e( 3) = -1.54469 eV ==== + psi = 0.152*[# 9]+0.152*[# 17]+0.152*[# 21]+0.152*[# 25]+0.046*[# 2] + +0.046*[# 3]+0.046*[# 4]+0.046*[# 6]+0.046*[# 7]+0.046*[# 8] + +0.046*[# 14]+0.046*[# 15]+0.046*[# 16]+0.046*[# 30]+0.046*[# 31] + +0.046*[# 32]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12]+0.014*[# 18] + +0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24] + +0.014*[# 26]+0.014*[# 27]+0.014*[# 28] + |psi|^2 = 1.330 +==== e( 4) = -1.54469 eV ==== + psi = 0.152*[# 9]+0.152*[# 17]+0.152*[# 21]+0.152*[# 25]+0.032*[# 2] + +0.032*[# 3]+0.032*[# 4]+0.032*[# 6]+0.032*[# 7]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 16]+0.032*[# 30]+0.032*[# 31] + +0.032*[# 32] + |psi|^2 = 0.994 +==== e( 5) = -1.54458 eV ==== + psi = 0.202*[# 5]+0.202*[# 13]+0.202*[# 29]+0.032*[# 10]+0.032*[# 11] + +0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22] + +0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28] + + |psi|^2 = 0.994 +==== e( 6) = -1.54312 eV ==== + psi = 0.304*[# 1]+0.101*[# 5]+0.101*[# 13]+0.101*[# 29]+0.048*[# 10] + +0.048*[# 11]+0.048*[# 12]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28] + |psi|^2 = 1.187 +==== e( 7) = 1.14721 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29] + |psi|^2 = 0.503 +==== e( 8) = 2.47079 eV ==== + psi = 0.065*[# 10]+0.065*[# 11]+0.065*[# 12]+0.065*[# 18]+0.065*[# 19] + +0.065*[# 20]+0.065*[# 22]+0.065*[# 23]+0.065*[# 24]+0.065*[# 26] + +0.065*[# 27]+0.065*[# 28]+0.003*[# 5]+0.003*[# 13]+0.003*[# 29] + + |psi|^2 = 0.789 +==== e( 9) = 2.47096 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 6]+0.049*[# 7] + +0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 16]+0.049*[# 30] + +0.049*[# 31]+0.049*[# 32]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.002*[# 9] + +0.002*[# 17]+0.002*[# 21]+0.002*[# 25] + |psi|^2 = 0.994 +==== e( 10) = 2.47096 eV ==== + psi = 0.096*[# 7]+0.096*[# 16]+0.096*[# 30]+0.095*[# 2]+0.095*[# 3] + +0.095*[# 4]+0.055*[# 6]+0.055*[# 8]+0.055*[# 14]+0.055*[# 15] + +0.055*[# 31]+0.055*[# 32]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.914 +==== e( 11) = 2.47113 eV ==== + psi = 0.082*[# 10]+0.082*[# 11]+0.082*[# 12]+0.082*[# 18]+0.082*[# 19] + +0.082*[# 20]+0.082*[# 22]+0.082*[# 23]+0.082*[# 24]+0.082*[# 26] + +0.082*[# 27]+0.082*[# 28]+0.004*[# 1]+0.002*[# 5]+0.002*[# 13] + +0.002*[# 29] + |psi|^2 = 0.994 +==== e( 12) = 3.72629 eV ==== + psi = 0.084*[# 6]+0.084*[# 8]+0.084*[# 14]+0.084*[# 15]+0.084*[# 31] + +0.084*[# 32]+0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.044*[# 7] + +0.044*[# 16]+0.044*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + |psi|^2 = 1.262 +==== e( 13) = 3.72629 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.993 +==== e( 14) = 4.12437 eV ==== + psi = 0.043*[# 1]+0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17] + +0.043*[# 21]+0.043*[# 25]+0.043*[# 29]+0.024*[# 10]+0.024*[# 11] + +0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22] + +0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28] + +0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.013*[# 6]+0.013*[# 7] + +0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.785 +==== e( 15) = 4.96156 eV ==== + psi = 0.068*[# 2]+0.068*[# 3]+0.068*[# 4]+0.067*[# 6]+0.067*[# 7] + +0.067*[# 8]+0.067*[# 10]+0.067*[# 11]+0.067*[# 12]+0.067*[# 14] + +0.067*[# 15]+0.067*[# 16]+0.067*[# 18]+0.067*[# 19]+0.067*[# 20] + +0.067*[# 22]+0.067*[# 23]+0.067*[# 24]+0.067*[# 26]+0.067*[# 27] + +0.067*[# 28]+0.067*[# 30]+0.067*[# 31]+0.067*[# 32] + |psi|^2 = 1.618 +==== e( 16) = 4.96156 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.983 + + k = 0.1666666667 0.0000000000 0.6666666667 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.002*[# 6]+0.002*[# 7]+0.002*[# 8]+0.002*[# 10] + +0.002*[# 11]+0.002*[# 12]+0.002*[# 14]+0.002*[# 15]+0.002*[# 16] + +0.002*[# 18]+0.002*[# 19]+0.002*[# 20]+0.002*[# 22]+0.002*[# 23] + +0.002*[# 24]+0.002*[# 26]+0.002*[# 27]+0.002*[# 28]+0.002*[# 30] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.713 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 7]+0.027*[# 8]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 16] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 30] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 1.296 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 0.986 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 7]+0.021*[# 8]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 14]+0.021*[# 15]+0.021*[# 16] + +0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23] + +0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.021*[# 30] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.056 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.596 +==== e( 8) = 1.85450 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.039*[# 6]+0.039*[# 7] + +0.039*[# 8]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 14] + +0.039*[# 15]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.039*[# 30]+0.039*[# 31]+0.039*[# 32] + |psi|^2 = 0.925 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.030*[# 6]+0.030*[# 14]+0.030*[# 32]+0.030*[# 2]+0.030*[# 3] + +0.030*[# 4]+0.030*[# 7]+0.030*[# 15]+0.030*[# 8]+0.030*[# 10] + +0.030*[# 11]+0.030*[# 12]+0.030*[# 28]+0.030*[# 31]+0.030*[# 16] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 30] + |psi|^2 = 0.722 +==== e( 11) = 3.29155 eV ==== + psi = 0.055*[# 6]+0.055*[# 7]+0.055*[# 8]+0.055*[# 14]+0.055*[# 15] + +0.055*[# 16]+0.055*[# 31]+0.055*[# 32]+0.055*[# 10]+0.055*[# 12] + +0.055*[# 11]+0.055*[# 18]+0.055*[# 19]+0.055*[# 20]+0.055*[# 30] + +0.055*[# 22]+0.055*[# 23]+0.055*[# 24]+0.055*[# 26]+0.055*[# 27] + +0.055*[# 28]+0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.349 +==== e( 12) = 3.36033 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 18] + +0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24] + +0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.797 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.044*[# 7]+0.043*[# 6] + +0.043*[# 8]+0.044*[# 10]+0.044*[# 16]+0.044*[# 11]+0.044*[# 12] + +0.043*[# 14]+0.043*[# 15]+0.044*[# 18]+0.044*[# 19]+0.044*[# 20] + +0.044*[# 30]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24]+0.044*[# 26] + +0.044*[# 27]+0.044*[# 28]+0.043*[# 31]+0.043*[# 32] + |psi|^2 = 1.048 +==== e( 15) = 4.50839 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.009 +==== e( 16) = 5.45761 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.047*[# 6]+0.047*[# 7] + +0.047*[# 8]+0.047*[# 10]+0.047*[# 11]+0.047*[# 12]+0.047*[# 14] + +0.047*[# 15]+0.047*[# 16]+0.047*[# 18]+0.047*[# 19]+0.047*[# 20] + +0.047*[# 22]+0.047*[# 23]+0.047*[# 24]+0.047*[# 26]+0.047*[# 27] + +0.047*[# 28]+0.047*[# 30]+0.047*[# 31]+0.047*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.168 + + k = 0.3333333333 0.0000000000 0.6666666667 +==== e( 1) = -4.87592 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.52951 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.959 +==== e( 3) = -3.52873 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.54529 eV ==== + psi = 0.085*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.085*[# 5]+0.085*[# 13]+0.085*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11] + +0.016*[# 12]+0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19] + +0.016*[# 20]+0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26] + +0.016*[# 27]+0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.055 +==== e( 5) = -0.62188 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.994 +==== e( 6) = 0.50951 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.061*[# 9]+0.061*[# 17] + +0.061*[# 21]+0.061*[# 25]+0.026*[# 6]+0.026*[# 8]+0.026*[# 14] + +0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.018*[# 10]+0.018*[# 11] + +0.018*[# 12]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22] + +0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28] + +0.015*[# 2]+0.015*[# 3]+0.015*[# 4]+0.005*[# 7]+0.005*[# 16] + +0.005*[# 30] + |psi|^2 = 0.910 +==== e( 7) = 0.50974 eV ==== + psi = 0.122*[# 1]+0.061*[# 9]+0.061*[# 17]+0.061*[# 21]+0.061*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.029*[# 2]+0.029*[# 3] + +0.029*[# 4]+0.029*[# 7]+0.029*[# 16]+0.029*[# 30]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.992 +==== e( 8) = 1.69051 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.035*[# 6]+0.035*[# 8] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14]+0.035*[# 15] + +0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23] + +0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 31] + +0.035*[# 32]+0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.002*[# 1] + +0.002*[# 5]+0.002*[# 9]+0.002*[# 13]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.002*[# 29] + |psi|^2 = 0.857 +==== e( 9) = 2.43371 eV ==== + psi = 0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17]+0.043*[# 21] + +0.043*[# 25]+0.043*[# 29]+0.043*[# 1]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 0.987 +==== e( 10) = 2.54749 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.049*[# 2]+0.049*[# 3] + +0.049*[# 4]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.015*[# 1] + +0.008*[# 9]+0.008*[# 17]+0.008*[# 21]+0.008*[# 25]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29] + |psi|^2 = 0.979 +==== e( 11) = 2.54759 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29]+0.008*[# 9]+0.008*[# 17]+0.008*[# 21] + +0.008*[# 25] + |psi|^2 = 0.992 +==== e( 12) = 3.71718 eV ==== + psi = 0.049*[# 7]+0.049*[# 16]+0.049*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23] + +0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.040*[# 31] + +0.040*[# 32]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.027 +==== e( 13) = 3.84161 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 14]+0.050*[# 15]+0.050*[# 31]+0.050*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.002*[# 5]+0.002*[# 13]+0.002*[# 29]+0.001*[# 9] + +0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 3.84259 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.049*[# 7]+0.049*[# 16] + +0.049*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 15) = 4.03675 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.878 +==== e( 16) = 5.60339 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.036*[# 6]+0.036*[# 8] + +0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 14]+0.036*[# 15] + +0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23] + +0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.036*[# 31] + +0.036*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.873 + + k = 0.5000000000 0.0000000000 0.6666666667 +==== e( 1) = -4.30426 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.30321 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.017*[# 10] + +0.017*[# 11]+0.017*[# 12]+0.017*[# 18]+0.017*[# 19]+0.017*[# 20] + +0.017*[# 22]+0.017*[# 23]+0.017*[# 24]+0.017*[# 26]+0.017*[# 27] + +0.017*[# 28]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.001*[# 7] + +0.001*[# 16]+0.001*[# 30] + |psi|^2 = 1.117 +==== e( 3) = -3.08338 eV ==== + psi = 0.113*[# 5]+0.113*[# 13]+0.113*[# 29]+0.084*[# 9]+0.084*[# 17] + +0.084*[# 21]+0.084*[# 25]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.889 +==== e( 4) = -3.08238 eV ==== + psi = 0.169*[# 1]+0.084*[# 9]+0.084*[# 17]+0.084*[# 21]+0.084*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.022*[# 7]+0.022*[# 16] + +0.022*[# 30]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28] + |psi|^2 = 1.012 +==== e( 5) = -0.06735 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.060*[# 9]+0.060*[# 17] + +0.060*[# 21]+0.060*[# 25]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + +0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19] + +0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26] + +0.021*[# 27]+0.021*[# 28]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 16]+0.018*[# 30]+0.018*[# 31] + +0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.06705 eV ==== + psi = 0.121*[# 1]+0.060*[# 9]+0.060*[# 17]+0.060*[# 21]+0.060*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.024*[# 7]+0.024*[# 16] + +0.024*[# 30]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.920 +==== e( 7) = 1.46284 eV ==== + psi = 0.102*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30]+0.012*[# 2] + +0.012*[# 3]+0.012*[# 4] + |psi|^2 = 1.009 +==== e( 8) = 1.46285 eV ==== + psi = 0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.038*[# 2]+0.038*[# 3]+0.038*[# 4] + +0.025*[# 7]+0.025*[# 16]+0.025*[# 30]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22] + +0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + +0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15]+0.012*[# 31] + +0.012*[# 32] + |psi|^2 = 0.936 +==== e( 9) = 1.95717 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 1.95751 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.047*[# 7]+0.047*[# 16] + +0.047*[# 30]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 1.057 +==== e( 11) = 3.02286 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.020*[# 1]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.007*[# 5]+0.007*[# 13]+0.007*[# 29] + |psi|^2 = 0.956 +==== e( 12) = 3.02323 eV ==== + psi = 0.078*[# 2]+0.078*[# 3]+0.078*[# 4]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.033*[# 6]+0.033*[# 8]+0.033*[# 14]+0.033*[# 15]+0.033*[# 31] + +0.033*[# 32]+0.013*[# 5]+0.013*[# 13]+0.013*[# 29]+0.013*[# 7] + +0.013*[# 16]+0.013*[# 30]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25] + |psi|^2 = 1.020 +==== e( 13) = 4.06622 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 4.06644 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.979 +==== e( 15) = 4.88257 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.034*[# 7]+0.034*[# 16]+0.034*[# 30]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.966 +==== e( 16) = 4.88277 eV ==== + psi = 0.056*[# 6]+0.056*[# 8]+0.056*[# 14]+0.056*[# 15]+0.056*[# 31] + +0.056*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.004*[# 1]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.001*[# 5]+0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.955 + + k = 0.6666666667 0.0000000000 0.6666666667 +==== e( 1) = -4.87592 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.52951 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.959 +==== e( 3) = -3.52873 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.54529 eV ==== + psi = 0.085*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.085*[# 5]+0.085*[# 13]+0.085*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11] + +0.016*[# 12]+0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19] + +0.016*[# 20]+0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26] + +0.016*[# 27]+0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.055 +==== e( 5) = -0.62188 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.994 +==== e( 6) = 0.50951 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.061*[# 9]+0.061*[# 17] + +0.061*[# 21]+0.061*[# 25]+0.026*[# 6]+0.026*[# 8]+0.026*[# 14] + +0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.018*[# 10]+0.018*[# 11] + +0.018*[# 12]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22] + +0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28] + +0.015*[# 2]+0.015*[# 3]+0.015*[# 4]+0.005*[# 7]+0.005*[# 16] + +0.005*[# 30] + |psi|^2 = 0.910 +==== e( 7) = 0.50974 eV ==== + psi = 0.122*[# 1]+0.061*[# 9]+0.061*[# 17]+0.061*[# 21]+0.061*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.029*[# 2]+0.029*[# 3] + +0.029*[# 4]+0.029*[# 7]+0.029*[# 16]+0.029*[# 30]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.992 +==== e( 8) = 1.69051 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.035*[# 6]+0.035*[# 8] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14]+0.035*[# 15] + +0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23] + +0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 31] + +0.035*[# 32]+0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.002*[# 1] + +0.002*[# 5]+0.002*[# 9]+0.002*[# 13]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.002*[# 29] + |psi|^2 = 0.857 +==== e( 9) = 2.43371 eV ==== + psi = 0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17]+0.043*[# 21] + +0.043*[# 25]+0.043*[# 29]+0.043*[# 1]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 0.987 +==== e( 10) = 2.54749 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.049*[# 2]+0.049*[# 3] + +0.049*[# 4]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.015*[# 1] + +0.008*[# 9]+0.008*[# 17]+0.008*[# 21]+0.008*[# 25]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29] + |psi|^2 = 0.979 +==== e( 11) = 2.54759 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29]+0.008*[# 9]+0.008*[# 17]+0.008*[# 21] + +0.008*[# 25] + |psi|^2 = 0.992 +==== e( 12) = 3.71718 eV ==== + psi = 0.049*[# 7]+0.049*[# 16]+0.049*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23] + +0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.040*[# 31] + +0.040*[# 32]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.027 +==== e( 13) = 3.84161 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 14]+0.050*[# 15]+0.050*[# 31]+0.050*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.002*[# 5]+0.002*[# 13]+0.002*[# 29]+0.001*[# 9] + +0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 3.84259 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.049*[# 7]+0.049*[# 16] + +0.049*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 15) = 4.03675 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.878 +==== e( 16) = 5.60339 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.036*[# 6]+0.036*[# 8] + +0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 14]+0.036*[# 15] + +0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23] + +0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.036*[# 31] + +0.036*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.873 + + k = 0.8333333333 0.0000000000 0.6666666667 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.002*[# 6]+0.002*[# 7]+0.002*[# 8]+0.002*[# 10] + +0.002*[# 11]+0.002*[# 12]+0.002*[# 14]+0.002*[# 15]+0.002*[# 16] + +0.002*[# 18]+0.002*[# 19]+0.002*[# 20]+0.002*[# 22]+0.002*[# 23] + +0.002*[# 24]+0.002*[# 26]+0.002*[# 27]+0.002*[# 28]+0.002*[# 30] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.713 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 7]+0.027*[# 8]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 16] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 30] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 1.296 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 0.986 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 7]+0.021*[# 8]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 14]+0.021*[# 15]+0.021*[# 16] + +0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23] + +0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.021*[# 30] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.056 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.596 +==== e( 8) = 1.85450 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.039*[# 6]+0.039*[# 7] + +0.039*[# 8]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 14] + +0.039*[# 15]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.039*[# 30]+0.039*[# 31]+0.039*[# 32] + |psi|^2 = 0.925 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.030*[# 6]+0.030*[# 14]+0.030*[# 32]+0.030*[# 2]+0.030*[# 3] + +0.030*[# 4]+0.030*[# 7]+0.030*[# 15]+0.030*[# 8]+0.030*[# 10] + +0.030*[# 11]+0.030*[# 12]+0.030*[# 28]+0.030*[# 31]+0.030*[# 16] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 30] + |psi|^2 = 0.722 +==== e( 11) = 3.29155 eV ==== + psi = 0.055*[# 6]+0.055*[# 7]+0.055*[# 8]+0.055*[# 14]+0.055*[# 15] + +0.055*[# 16]+0.055*[# 31]+0.055*[# 32]+0.055*[# 10]+0.055*[# 12] + +0.055*[# 11]+0.055*[# 18]+0.055*[# 19]+0.055*[# 20]+0.055*[# 30] + +0.055*[# 22]+0.055*[# 23]+0.055*[# 24]+0.055*[# 26]+0.055*[# 27] + +0.055*[# 28]+0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.349 +==== e( 12) = 3.36033 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 18] + +0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24] + +0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.797 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.044*[# 7]+0.043*[# 6] + +0.043*[# 8]+0.044*[# 10]+0.044*[# 16]+0.044*[# 11]+0.044*[# 12] + +0.043*[# 14]+0.043*[# 15]+0.044*[# 18]+0.044*[# 19]+0.044*[# 20] + +0.044*[# 30]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24]+0.044*[# 26] + +0.044*[# 27]+0.044*[# 28]+0.043*[# 31]+0.043*[# 32] + |psi|^2 = 1.048 +==== e( 15) = 4.50839 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.009 +==== e( 16) = 5.45761 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.047*[# 6]+0.047*[# 7] + +0.047*[# 8]+0.047*[# 10]+0.047*[# 11]+0.047*[# 12]+0.047*[# 14] + +0.047*[# 15]+0.047*[# 16]+0.047*[# 18]+0.047*[# 19]+0.047*[# 20] + +0.047*[# 22]+0.047*[# 23]+0.047*[# 24]+0.047*[# 26]+0.047*[# 27] + +0.047*[# 28]+0.047*[# 30]+0.047*[# 31]+0.047*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.168 + + k = 0.0000000000 0.1666666667 0.6666666667 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1] + |psi|^2 = 0.679 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 7]+0.027*[# 8]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 16] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 30] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 1.296 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.980 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 6]+0.032*[# 7]+0.032*[# 8]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15]+0.032*[# 16] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 30] + +0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.332 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.596 +==== e( 8) = 1.85450 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.032*[# 6]+0.032*[# 7] + +0.032*[# 8]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 14] + +0.032*[# 15]+0.032*[# 16]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28]+0.032*[# 30]+0.032*[# 31]+0.032*[# 32] + |psi|^2 = 0.767 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.042*[# 2]+0.042*[# 3]+0.042*[# 4]+0.042*[# 6]+0.042*[# 7] + +0.042*[# 8]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 14] + +0.042*[# 15]+0.042*[# 16]+0.042*[# 18]+0.042*[# 19]+0.042*[# 20] + +0.042*[# 22]+0.042*[# 23]+0.042*[# 24]+0.042*[# 26]+0.042*[# 27] + +0.042*[# 28]+0.042*[# 30]+0.042*[# 31]+0.042*[# 32] + |psi|^2 = 1.013 +==== e( 11) = 3.29155 eV ==== + psi = 0.055*[# 6]+0.055*[# 7]+0.055*[# 8]+0.055*[# 14]+0.055*[# 15] + +0.055*[# 16]+0.055*[# 31]+0.055*[# 32]+0.055*[# 10]+0.055*[# 12] + +0.055*[# 11]+0.055*[# 18]+0.055*[# 19]+0.055*[# 20]+0.055*[# 30] + +0.055*[# 22]+0.055*[# 23]+0.055*[# 24]+0.055*[# 26]+0.055*[# 27] + +0.055*[# 28]+0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.349 +==== e( 12) = 3.36033 eV ==== + psi = 0.036*[# 2]+0.036*[# 3]+0.036*[# 4]+0.036*[# 7]+0.036*[# 16] + +0.036*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.036*[# 6]+0.036*[# 8] + +0.036*[# 14]+0.036*[# 15]+0.036*[# 31]+0.036*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.879 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.043*[# 7]+0.043*[# 16] + +0.043*[# 30]+0.043*[# 6]+0.043*[# 8]+0.043*[# 10]+0.043*[# 11] + +0.043*[# 12]+0.043*[# 14]+0.043*[# 15]+0.043*[# 18]+0.043*[# 19] + +0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24]+0.043*[# 26] + +0.043*[# 27]+0.043*[# 28]+0.043*[# 31]+0.043*[# 32] + |psi|^2 = 1.026 +==== e( 15) = 4.50839 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.009 +==== e( 16) = 5.45761 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14]+0.041*[# 15] + +0.041*[# 7]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 32] + +0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 30]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.015 + + k = 0.1666666667 0.1666666667 0.6666666667 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.730 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.025*[# 31]+0.025*[# 32]+0.025*[# 7]+0.025*[# 16] + +0.025*[# 30] + |psi|^2 = 1.271 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 10]+0.014*[# 11] + +0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 18]+0.014*[# 19] + +0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26] + +0.014*[# 27]+0.014*[# 28]+0.014*[# 31]+0.014*[# 32]+0.013*[# 2] + +0.013*[# 3]+0.013*[# 4] + |psi|^2 = 0.990 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.041*[# 7]+0.041*[# 16] + +0.041*[# 30]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 18] + +0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24] + +0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.133 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.742 +==== e( 8) = 2.16363 eV ==== + psi = 0.043*[# 7]+0.043*[# 16]+0.043*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.899 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 7]+0.038*[# 16] + +0.038*[# 30]+0.036*[# 1]+0.036*[# 5]+0.036*[# 9]+0.036*[# 13] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.036*[# 29]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15] + +0.025*[# 31]+0.025*[# 32] + |psi|^2 = 1.049 +==== e( 11) = 3.13966 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.037*[# 6]+0.037*[# 7] + +0.037*[# 8]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 16]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.037*[# 30]+0.037*[# 31]+0.037*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.963 +==== e( 12) = 3.51483 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.756 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.054*[# 6]+0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31] + +0.054*[# 32]+0.052*[# 10]+0.052*[# 11]+0.052*[# 12]+0.052*[# 18] + +0.052*[# 19]+0.052*[# 20]+0.052*[# 22]+0.052*[# 23]+0.052*[# 24] + +0.052*[# 26]+0.052*[# 27]+0.052*[# 28]+0.050*[# 2]+0.050*[# 3] + +0.050*[# 4]+0.050*[# 7]+0.050*[# 16]+0.050*[# 30] + |psi|^2 = 1.256 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.983 +==== e( 16) = 5.23066 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 6]+0.035*[# 7] + +0.035*[# 8]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 16]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.035*[# 30]+0.035*[# 31]+0.035*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.927 + + k = 0.3333333333 0.1666666667 0.6666666667 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.961 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.015*[# 6]+0.015*[# 8]+0.015*[# 10]+0.015*[# 11] + +0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 18]+0.015*[# 19] + +0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26] + +0.015*[# 27]+0.015*[# 28]+0.015*[# 31]+0.015*[# 32]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.072 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.032*[# 6]+0.032*[# 8]+0.032*[# 14] + +0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.023*[# 10]+0.023*[# 11] + +0.023*[# 12]+0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22] + +0.023*[# 23]+0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.962 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 18]+0.027*[# 19] + +0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26] + +0.027*[# 27]+0.027*[# 28]+0.027*[# 31]+0.027*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 0.953 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.018*[# 7] + +0.018*[# 16]+0.018*[# 30]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.978 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + |psi|^2 = 0.907 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.035*[# 6]+0.035*[# 8] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14]+0.035*[# 15] + +0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23] + +0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 31] + +0.035*[# 32]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30] + |psi|^2 = 0.835 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 + + k = 0.5000000000 0.1666666667 0.6666666667 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 1.108 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.911 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.023*[# 7]+0.023*[# 16] + +0.023*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 1.025 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.025*[# 2] + +0.025*[# 3]+0.025*[# 4]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.013*[# 7] + +0.013*[# 16]+0.013*[# 30] + |psi|^2 = 0.956 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.037*[# 7]+0.037*[# 16]+0.037*[# 30] + +0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.019*[# 1]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.987 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4]+0.013*[# 7] + +0.013*[# 16]+0.013*[# 30] + |psi|^2 = 0.952 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.031*[# 6]+0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31] + +0.031*[# 32]+0.029*[# 1]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.964 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 1.047 +==== e( 12) = 3.70168 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.046*[# 6]+0.046*[# 8] + +0.046*[# 14]+0.046*[# 15]+0.046*[# 31]+0.046*[# 32]+0.038*[# 10] + +0.038*[# 11]+0.038*[# 12]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.028*[# 1]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.010*[# 5]+0.010*[# 13]+0.010*[# 29]+0.007*[# 7] + +0.007*[# 16]+0.007*[# 30] + |psi|^2 = 1.018 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.040*[# 2]+0.040*[# 3] + +0.040*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.002*[# 1] + + |psi|^2 = 1.058 +==== e( 15) = 4.84656 eV ==== + psi = 0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.879 +==== e( 16) = 4.84692 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.041*[# 7]+0.041*[# 16]+0.041*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.947 + + k = 0.6666666667 0.1666666667 0.6666666667 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.961 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.015*[# 6]+0.015*[# 8]+0.015*[# 10]+0.015*[# 11] + +0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 18]+0.015*[# 19] + +0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26] + +0.015*[# 27]+0.015*[# 28]+0.015*[# 31]+0.015*[# 32]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.072 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.032*[# 6]+0.032*[# 8]+0.032*[# 14] + +0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.023*[# 10]+0.023*[# 11] + +0.023*[# 12]+0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22] + +0.023*[# 23]+0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.962 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 18]+0.027*[# 19] + +0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26] + +0.027*[# 27]+0.027*[# 28]+0.027*[# 31]+0.027*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 0.953 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.018*[# 7] + +0.018*[# 16]+0.018*[# 30]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.978 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + |psi|^2 = 0.907 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.035*[# 6]+0.035*[# 8] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14]+0.035*[# 15] + +0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23] + +0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 31] + +0.035*[# 32]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30] + |psi|^2 = 0.835 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 + + k = 0.8333333333 0.1666666667 0.6666666667 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.730 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.025*[# 31]+0.025*[# 32]+0.025*[# 7]+0.025*[# 16] + +0.025*[# 30] + |psi|^2 = 1.271 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 10]+0.014*[# 11] + +0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 18]+0.014*[# 19] + +0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26] + +0.014*[# 27]+0.014*[# 28]+0.014*[# 31]+0.014*[# 32]+0.013*[# 2] + +0.013*[# 3]+0.013*[# 4] + |psi|^2 = 0.990 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.041*[# 7]+0.041*[# 16] + +0.041*[# 30]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 18] + +0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24] + +0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.133 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.742 +==== e( 8) = 2.16363 eV ==== + psi = 0.043*[# 7]+0.043*[# 16]+0.043*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.899 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 7]+0.038*[# 16] + +0.038*[# 30]+0.036*[# 1]+0.036*[# 5]+0.036*[# 9]+0.036*[# 13] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.036*[# 29]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15] + +0.025*[# 31]+0.025*[# 32] + |psi|^2 = 1.049 +==== e( 11) = 3.13966 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.037*[# 6]+0.037*[# 7] + +0.037*[# 8]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 16]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.037*[# 30]+0.037*[# 31]+0.037*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.963 +==== e( 12) = 3.51483 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.756 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.054*[# 6]+0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31] + +0.054*[# 32]+0.052*[# 10]+0.052*[# 11]+0.052*[# 12]+0.052*[# 18] + +0.052*[# 19]+0.052*[# 20]+0.052*[# 22]+0.052*[# 23]+0.052*[# 24] + +0.052*[# 26]+0.052*[# 27]+0.052*[# 28]+0.050*[# 2]+0.050*[# 3] + +0.050*[# 4]+0.050*[# 7]+0.050*[# 16]+0.050*[# 30] + |psi|^2 = 1.256 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.983 +==== e( 16) = 5.23066 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 6]+0.035*[# 7] + +0.035*[# 8]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 16]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.035*[# 30]+0.035*[# 31]+0.035*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.927 + + k = 0.0000000000 0.3333333333 0.6666666667 +==== e( 1) = -4.87592 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.52951 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15]+0.009*[# 31] + +0.009*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.002*[# 7]+0.002*[# 16] + +0.002*[# 30] + |psi|^2 = 0.848 +==== e( 3) = -3.52873 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.54529 eV ==== + psi = 0.085*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.085*[# 5]+0.085*[# 13]+0.085*[# 29]+0.011*[# 7]+0.011*[# 16] + +0.011*[# 30]+0.010*[# 6]+0.010*[# 8]+0.010*[# 10]+0.010*[# 11] + +0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.010*[# 31]+0.010*[# 32]+0.009*[# 2] + +0.009*[# 3]+0.009*[# 4] + |psi|^2 = 0.929 +==== e( 5) = -0.62188 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.994 +==== e( 6) = 0.50951 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.061*[# 9]+0.061*[# 17] + +0.061*[# 21]+0.061*[# 25]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.016*[# 7]+0.016*[# 16] + +0.016*[# 30] + |psi|^2 = 1.178 +==== e( 7) = 0.50974 eV ==== + psi = 0.122*[# 1]+0.061*[# 9]+0.061*[# 17]+0.061*[# 21]+0.061*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.029*[# 2]+0.029*[# 3] + +0.029*[# 4]+0.029*[# 7]+0.029*[# 16]+0.029*[# 30]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.992 +==== e( 8) = 1.69051 eV ==== + psi = 0.045*[# 7]+0.045*[# 16]+0.045*[# 30]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.002*[# 1] + +0.002*[# 5]+0.002*[# 9]+0.002*[# 13]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.002*[# 29] + |psi|^2 = 0.892 +==== e( 9) = 2.43371 eV ==== + psi = 0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17]+0.043*[# 21] + +0.043*[# 25]+0.043*[# 29]+0.043*[# 1]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 0.987 +==== e( 10) = 2.54749 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.049*[# 2]+0.049*[# 3] + +0.049*[# 4]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.015*[# 1] + +0.008*[# 9]+0.008*[# 17]+0.008*[# 21]+0.008*[# 25]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29] + |psi|^2 = 0.981 +==== e( 11) = 2.54759 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29]+0.008*[# 9]+0.008*[# 17]+0.008*[# 21] + +0.008*[# 25] + |psi|^2 = 0.992 +==== e( 12) = 3.71718 eV ==== + psi = 0.070*[# 2]+0.070*[# 3]+0.070*[# 4]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 14]+0.050*[# 15] + +0.050*[# 18]+0.050*[# 19]+0.050*[# 20]+0.050*[# 22]+0.050*[# 23] + +0.050*[# 24]+0.050*[# 26]+0.050*[# 27]+0.050*[# 28]+0.050*[# 31] + +0.050*[# 32]+0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.277 +==== e( 13) = 3.84161 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 14]+0.050*[# 15]+0.050*[# 31]+0.050*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.002*[# 5]+0.002*[# 13]+0.002*[# 29]+0.001*[# 9] + +0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 3.84259 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.036*[# 7]+0.036*[# 16] + +0.036*[# 30]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 18] + +0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23]+0.034*[# 24] + +0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.822 +==== e( 15) = 4.03675 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.878 +==== e( 16) = 5.60339 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.029*[# 6]+0.029*[# 8] + +0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14]+0.029*[# 15] + +0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23] + +0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.029*[# 31] + +0.029*[# 32]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30] + |psi|^2 = 0.705 + + k = 0.1666666667 0.3333333333 0.6666666667 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15]+0.010*[# 31] + +0.010*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.883 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30]+0.011*[# 6]+0.011*[# 8]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 18]+0.011*[# 19] + +0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26] + +0.011*[# 27]+0.011*[# 28]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2] + +0.009*[# 3]+0.009*[# 4] + |psi|^2 = 0.963 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.013*[# 7]+0.013*[# 16] + +0.013*[# 30] + |psi|^2 = 1.093 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.019*[# 2] + +0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.991 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.031*[# 2]+0.031*[# 3] + +0.031*[# 4]+0.025*[# 7]+0.025*[# 16]+0.025*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 1.160 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.055*[# 7]+0.055*[# 16]+0.055*[# 30]+0.055*[# 6]+0.055*[# 8] + +0.055*[# 14]+0.055*[# 15]+0.055*[# 31]+0.055*[# 32]+0.042*[# 10] + +0.042*[# 11]+0.042*[# 12]+0.042*[# 18]+0.042*[# 19]+0.042*[# 20] + +0.042*[# 22]+0.042*[# 23]+0.042*[# 24]+0.042*[# 26]+0.042*[# 27] + +0.042*[# 28]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4] + |psi|^2 = 1.016 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.034*[# 6]+0.034*[# 8] + +0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.804 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.020*[# 6]+0.020*[# 7] + +0.020*[# 8]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 14] + +0.020*[# 15]+0.020*[# 16]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.020*[# 30]+0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.492 + + k = 0.3333333333 0.3333333333 0.6666666667 +==== e( 1) = -4.44567 eV ==== + psi = 0.093*[# 5]+0.093*[# 9]+0.093*[# 13]+0.093*[# 17]+0.093*[# 21] + +0.093*[# 25]+0.093*[# 29]+0.092*[# 1]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4]+0.011*[# 6]+0.011*[# 7]+0.011*[# 8]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 16] + +0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23] + +0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.011*[# 30] + +0.011*[# 31]+0.011*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18] + +0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24] + +0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 1.029 +==== e( 3) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14] + +0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.002*[# 7]+0.002*[# 16] + +0.002*[# 30] + |psi|^2 = 0.916 +==== e( 4) = -3.32159 eV ==== + psi = 0.272*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.030*[# 5]+0.030*[# 13]+0.030*[# 29]+0.025*[# 7]+0.025*[# 16] + +0.025*[# 30]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15] + +0.006*[# 31]+0.006*[# 32] + |psi|^2 = 1.008 +==== e( 5) = -0.47745 eV ==== + psi = 0.124*[# 1]+0.081*[# 7]+0.081*[# 16]+0.081*[# 30]+0.041*[# 9] + +0.041*[# 17]+0.041*[# 21]+0.041*[# 25]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.014*[# 5]+0.014*[# 13]+0.014*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.990 +==== e( 6) = -0.47735 eV ==== + psi = 0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.041*[# 9]+0.041*[# 17] + +0.041*[# 21]+0.041*[# 25]+0.038*[# 2]+0.038*[# 3]+0.038*[# 4] + +0.034*[# 6]+0.034*[# 8]+0.034*[# 14]+0.034*[# 15]+0.034*[# 31] + +0.034*[# 32]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.989 +==== e( 7) = -0.47735 eV ==== + psi = 0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.047*[# 6]+0.047*[# 8] + +0.047*[# 14]+0.047*[# 15]+0.047*[# 31]+0.047*[# 32]+0.041*[# 9] + +0.041*[# 17]+0.041*[# 21]+0.041*[# 25]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.016*[# 2]+0.016*[# 3]+0.016*[# 4] + |psi|^2 = 0.992 +==== e( 8) = 0.79675 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.039*[# 1]+0.039*[# 5] + +0.039*[# 9]+0.039*[# 13]+0.039*[# 17]+0.039*[# 21]+0.039*[# 25] + +0.039*[# 29]+0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.028*[# 10] + +0.028*[# 11]+0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.981 +==== e( 9) = 3.35691 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4] + |psi|^2 = 0.991 +==== e( 10) = 3.35691 eV ==== + psi = 0.048*[# 6]+0.048*[# 8]+0.048*[# 14]+0.048*[# 15]+0.048*[# 31] + +0.048*[# 32]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 18] + +0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23]+0.032*[# 24] + +0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.023*[# 5]+0.023*[# 7] + +0.023*[# 13]+0.023*[# 16]+0.023*[# 29]+0.023*[# 30]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4] + |psi|^2 = 0.898 +==== e( 11) = 3.35799 eV ==== + psi = 0.063*[# 2]+0.063*[# 3]+0.063*[# 4]+0.052*[# 1]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.037*[# 7]+0.037*[# 16]+0.037*[# 30]+0.027*[# 6] + +0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32] + +0.017*[# 9]+0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 1.067 +==== e( 12) = 4.37538 eV ==== + psi = 0.066*[# 6]+0.066*[# 8]+0.066*[# 14]+0.066*[# 15]+0.066*[# 31] + +0.066*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.024*[# 7]+0.024*[# 16] + +0.024*[# 30]+0.004*[# 2]+0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.961 +==== e( 13) = 4.37596 eV ==== + psi = 0.062*[# 7]+0.062*[# 16]+0.062*[# 30]+0.062*[# 2]+0.062*[# 3] + +0.062*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.990 +==== e( 14) = 4.37596 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.053*[# 7]+0.053*[# 16] + +0.053*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32] + |psi|^2 = 0.995 +==== e( 15) = 5.16112 eV ==== + psi = 0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.043*[# 7]+0.043*[# 16] + +0.043*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32] + |psi|^2 = 0.924 +==== e( 16) = 5.16112 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 14]+0.043*[# 15] + +0.043*[# 18]+0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23] + +0.043*[# 24]+0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.043*[# 31] + +0.043*[# 32]+0.035*[# 7]+0.035*[# 16]+0.035*[# 30] + |psi|^2 = 1.044 + + k = 0.5000000000 0.3333333333 0.6666666667 +==== e( 1) = -3.94104 eV ==== + psi = 0.122*[# 5]+0.122*[# 13]+0.122*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.94002 eV ==== + psi = 0.182*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.061*[# 5]+0.061*[# 13]+0.061*[# 29]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.015*[# 2] + +0.015*[# 3]+0.015*[# 4]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.004*[# 7] + +0.004*[# 16]+0.004*[# 30] + |psi|^2 = 1.079 +==== e( 3) = -3.23789 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.094*[# 9]+0.094*[# 17] + +0.094*[# 21]+0.094*[# 25]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14] + +0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18] + +0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24] + +0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.962 +==== e( 4) = -3.23693 eV ==== + psi = 0.189*[# 1]+0.094*[# 9]+0.094*[# 17]+0.094*[# 21]+0.094*[# 25] + +0.063*[# 5]+0.063*[# 13]+0.063*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 14]+0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.008*[# 2] + +0.008*[# 3]+0.008*[# 4] + |psi|^2 = 1.047 +==== e( 5) = -0.73636 eV ==== + psi = 0.073*[# 1]+0.058*[# 7]+0.058*[# 16]+0.058*[# 30]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.024*[# 5]+0.024*[# 13]+0.024*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.018*[# 2] + +0.018*[# 3]+0.018*[# 4] + |psi|^2 = 0.989 +==== e( 6) = -0.73621 eV ==== + psi = 0.048*[# 5]+0.048*[# 13]+0.048*[# 29]+0.038*[# 2]+0.038*[# 3] + +0.038*[# 4]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 31]+0.037*[# 32]+0.036*[# 9]+0.036*[# 17]+0.036*[# 21] + +0.036*[# 25]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + |psi|^2 = 0.963 +==== e( 7) = 0.03076 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.039*[# 9]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.038*[# 2]+0.038*[# 3]+0.038*[# 4] + +0.036*[# 7]+0.036*[# 16]+0.036*[# 30]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.016*[# 1] + |psi|^2 = 0.996 +==== e( 8) = 0.03135 eV ==== + psi = 0.062*[# 1]+0.039*[# 9]+0.039*[# 17]+0.039*[# 21]+0.039*[# 25] + +0.036*[# 6]+0.036*[# 8]+0.036*[# 14]+0.036*[# 15]+0.036*[# 31] + +0.036*[# 32]+0.031*[# 5]+0.031*[# 13]+0.031*[# 29]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20] + +0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27] + +0.027*[# 28]+0.019*[# 2]+0.019*[# 3]+0.019*[# 4]+0.019*[# 7] + +0.019*[# 16]+0.019*[# 30] + |psi|^2 = 0.970 +==== e( 9) = 3.53934 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.990 +==== e( 10) = 3.54036 eV ==== + psi = 0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.035*[# 1]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15] + +0.020*[# 31]+0.020*[# 32]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30] + +0.017*[# 9]+0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.012*[# 5] + +0.012*[# 13]+0.012*[# 29] + |psi|^2 = 0.728 +==== e( 11) = 4.50427 eV ==== + psi = 0.071*[# 6]+0.071*[# 8]+0.071*[# 14]+0.071*[# 15]+0.071*[# 31] + +0.071*[# 32]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.004*[# 7]+0.004*[# 16]+0.004*[# 30] + |psi|^2 = 1.149 +==== e( 12) = 4.50435 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.058*[# 2]+0.058*[# 3] + +0.058*[# 4]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.013*[# 6]+0.013*[# 8] + +0.013*[# 14]+0.013*[# 15]+0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.887 +==== e( 13) = 4.57402 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.024*[# 1]+0.017*[# 2] + +0.017*[# 3]+0.017*[# 4]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29] + |psi|^2 = 0.987 +==== e( 14) = 4.57418 eV ==== + psi = 0.101*[# 7]+0.101*[# 16]+0.101*[# 30]+0.055*[# 10]+0.055*[# 11] + +0.055*[# 12]+0.055*[# 18]+0.055*[# 19]+0.055*[# 20]+0.055*[# 22] + +0.055*[# 23]+0.055*[# 24]+0.055*[# 26]+0.055*[# 27]+0.055*[# 28] + +0.055*[# 2]+0.055*[# 3]+0.055*[# 4]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.016*[# 5] + +0.016*[# 13]+0.016*[# 29]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25] + |psi|^2 = 1.414 +==== e( 15) = 4.74870 eV ==== + psi = 0.049*[# 7]+0.049*[# 16]+0.049*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 31] + +0.027*[# 32]+0.005*[# 2]+0.005*[# 3]+0.005*[# 4] + |psi|^2 = 0.648 +==== e( 16) = 4.74983 eV ==== + psi = 0.090*[# 2]+0.090*[# 3]+0.090*[# 4]+0.045*[# 10]+0.045*[# 11] + +0.045*[# 12]+0.045*[# 18]+0.045*[# 19]+0.045*[# 20]+0.045*[# 22] + +0.045*[# 23]+0.045*[# 24]+0.045*[# 26]+0.045*[# 27]+0.045*[# 28] + +0.044*[# 6]+0.044*[# 8]+0.044*[# 14]+0.044*[# 15]+0.044*[# 31] + +0.044*[# 32]+0.001*[# 7]+0.001*[# 16]+0.001*[# 30] + |psi|^2 = 1.075 + + k = 0.6666666667 0.3333333333 0.6666666667 +==== e( 1) = -4.44567 eV ==== + psi = 0.093*[# 5]+0.093*[# 9]+0.093*[# 13]+0.093*[# 17]+0.093*[# 21] + +0.093*[# 25]+0.093*[# 29]+0.092*[# 1]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4]+0.011*[# 6]+0.011*[# 7]+0.011*[# 8]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 16] + +0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23] + +0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.011*[# 30] + +0.011*[# 31]+0.011*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18] + +0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24] + +0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 1.028 +==== e( 3) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14] + +0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.002*[# 7]+0.002*[# 16] + +0.002*[# 30] + |psi|^2 = 0.918 +==== e( 4) = -3.32159 eV ==== + psi = 0.272*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.030*[# 5]+0.030*[# 13]+0.030*[# 29]+0.022*[# 7]+0.022*[# 16] + +0.022*[# 30]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 1.018 +==== e( 5) = -0.47745 eV ==== + psi = 0.124*[# 1]+0.081*[# 7]+0.081*[# 16]+0.081*[# 30]+0.041*[# 9] + +0.041*[# 17]+0.041*[# 21]+0.041*[# 25]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.014*[# 5]+0.014*[# 13]+0.014*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.990 +==== e( 6) = -0.47735 eV ==== + psi = 0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.041*[# 9] + +0.041*[# 17]+0.041*[# 21]+0.041*[# 25]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.990 +==== e( 7) = -0.47735 eV ==== + psi = 0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.050*[# 2]+0.050*[# 3] + +0.050*[# 4]+0.041*[# 9]+0.041*[# 17]+0.041*[# 21]+0.041*[# 25] + +0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + |psi|^2 = 0.988 +==== e( 8) = 0.79675 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.035*[# 7]+0.035*[# 16] + +0.035*[# 30]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 0.983 +==== e( 9) = 3.35691 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4] + |psi|^2 = 0.991 +==== e( 10) = 3.35691 eV ==== + psi = 0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.034*[# 7]+0.034*[# 16]+0.034*[# 30]+0.031*[# 10] + +0.031*[# 11]+0.031*[# 12]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20] + +0.031*[# 22]+0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27] + +0.031*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4] + |psi|^2 = 0.895 +==== e( 11) = 3.35799 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.052*[# 1]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.029*[# 7]+0.029*[# 16]+0.029*[# 30]+0.028*[# 6] + +0.028*[# 8]+0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32] + +0.017*[# 9]+0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 1.017 +==== e( 12) = 4.37538 eV ==== + psi = 0.071*[# 6]+0.071*[# 8]+0.071*[# 14]+0.071*[# 15]+0.071*[# 31] + +0.071*[# 32]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + |psi|^2 = 1.014 +==== e( 13) = 4.37596 eV ==== + psi = 0.062*[# 7]+0.062*[# 16]+0.062*[# 30]+0.062*[# 2]+0.062*[# 3] + +0.062*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.990 +==== e( 14) = 4.37596 eV ==== + psi = 0.047*[# 2]+0.047*[# 3]+0.047*[# 4]+0.047*[# 7]+0.047*[# 16] + +0.047*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32] + |psi|^2 = 0.871 +==== e( 15) = 5.16112 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 7]+0.049*[# 16] + +0.049*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.029*[# 6]+0.029*[# 8] + +0.029*[# 14]+0.029*[# 15]+0.029*[# 31]+0.029*[# 32] + |psi|^2 = 0.944 +==== e( 16) = 5.16112 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.048*[# 6]+0.048*[# 8] + +0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 14]+0.048*[# 15] + +0.048*[# 18]+0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23] + +0.048*[# 24]+0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.048*[# 31] + +0.048*[# 32]+0.034*[# 7]+0.034*[# 16]+0.034*[# 30] + |psi|^2 = 1.148 + + k = 0.8333333333 0.3333333333 0.6666666667 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15]+0.010*[# 31] + +0.010*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.883 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30]+0.011*[# 6]+0.011*[# 8]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 18]+0.011*[# 19] + +0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26] + +0.011*[# 27]+0.011*[# 28]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2] + +0.009*[# 3]+0.009*[# 4] + |psi|^2 = 0.963 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.013*[# 7]+0.013*[# 16] + +0.013*[# 30] + |psi|^2 = 1.093 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.019*[# 2] + +0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.991 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.031*[# 2]+0.031*[# 3] + +0.031*[# 4]+0.025*[# 7]+0.025*[# 16]+0.025*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 1.160 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.055*[# 7]+0.055*[# 16]+0.055*[# 30]+0.055*[# 6]+0.055*[# 8] + +0.055*[# 14]+0.055*[# 15]+0.055*[# 31]+0.055*[# 32]+0.042*[# 10] + +0.042*[# 11]+0.042*[# 12]+0.042*[# 18]+0.042*[# 19]+0.042*[# 20] + +0.042*[# 22]+0.042*[# 23]+0.042*[# 24]+0.042*[# 26]+0.042*[# 27] + +0.042*[# 28]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4] + |psi|^2 = 1.016 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.034*[# 6]+0.034*[# 8] + +0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.804 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.020*[# 6]+0.020*[# 7] + +0.020*[# 8]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 14] + +0.020*[# 15]+0.020*[# 16]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.020*[# 30]+0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.492 + + k = 0.0000000000 0.5000000000 0.6666666667 +==== e( 1) = -4.30426 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.30321 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19]+0.009*[# 20] + +0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26]+0.009*[# 27] + +0.009*[# 28]+0.001*[# 2]+0.001*[# 3]+0.001*[# 4]+0.001*[# 7] + +0.001*[# 16]+0.001*[# 30] + |psi|^2 = 0.931 +==== e( 3) = -3.08338 eV ==== + psi = 0.113*[# 5]+0.113*[# 13]+0.113*[# 29]+0.084*[# 9]+0.084*[# 17] + +0.084*[# 21]+0.084*[# 25]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.889 +==== e( 4) = -3.08238 eV ==== + psi = 0.169*[# 1]+0.084*[# 9]+0.084*[# 17]+0.084*[# 21]+0.084*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.009*[# 6]+0.009*[# 8] + +0.009*[# 14]+0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30]+0.006*[# 10]+0.006*[# 11]+0.006*[# 12] + +0.006*[# 18]+0.006*[# 19]+0.006*[# 20]+0.006*[# 22]+0.006*[# 23] + +0.006*[# 24]+0.006*[# 26]+0.006*[# 27]+0.006*[# 28] + |psi|^2 = 0.826 +==== e( 5) = -0.06735 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.060*[# 9]+0.060*[# 17] + +0.060*[# 21]+0.060*[# 25]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + +0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19] + +0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26] + +0.021*[# 27]+0.021*[# 28]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 16]+0.018*[# 30]+0.018*[# 31] + +0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.06705 eV ==== + psi = 0.121*[# 1]+0.060*[# 9]+0.060*[# 17]+0.060*[# 21]+0.060*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20] + +0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27] + +0.027*[# 28]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4]+0.024*[# 7] + +0.024*[# 16]+0.024*[# 30] + |psi|^2 = 1.138 +==== e( 7) = 1.46284 eV ==== + psi = 0.102*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30]+0.012*[# 2] + +0.012*[# 3]+0.012*[# 4] + |psi|^2 = 1.009 +==== e( 8) = 1.46285 eV ==== + psi = 0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30] + +0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.031*[# 10]+0.031*[# 11] + +0.031*[# 12]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22] + +0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + +0.022*[# 6]+0.022*[# 8]+0.022*[# 14]+0.022*[# 15]+0.022*[# 31] + +0.022*[# 32] + |psi|^2 = 1.154 +==== e( 9) = 1.95717 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 1.95751 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.061*[# 7]+0.061*[# 16] + +0.061*[# 30]+0.049*[# 10]+0.049*[# 11]+0.049*[# 12]+0.049*[# 18] + +0.049*[# 19]+0.049*[# 20]+0.049*[# 22]+0.049*[# 23]+0.049*[# 24] + +0.049*[# 26]+0.049*[# 27]+0.049*[# 28]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 14]+0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 1.223 +==== e( 11) = 3.02286 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.020*[# 1]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.007*[# 5]+0.007*[# 13]+0.007*[# 29] + |psi|^2 = 0.956 +==== e( 12) = 3.02323 eV ==== + psi = 0.092*[# 2]+0.092*[# 3]+0.092*[# 4]+0.046*[# 10]+0.046*[# 11] + +0.046*[# 12]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20]+0.046*[# 22] + +0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27]+0.046*[# 28] + +0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15]+0.040*[# 31] + +0.040*[# 32]+0.013*[# 5]+0.013*[# 13]+0.013*[# 29]+0.013*[# 7] + +0.013*[# 16]+0.013*[# 30]+0.010*[# 9]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25] + |psi|^2 = 1.186 +==== e( 13) = 4.06622 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 4.06644 eV ==== + psi = 0.044*[# 6]+0.044*[# 8]+0.044*[# 14]+0.044*[# 15]+0.044*[# 31] + +0.044*[# 32]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.612 +==== e( 15) = 4.88257 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.034*[# 7]+0.034*[# 16]+0.034*[# 30]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.966 +==== e( 16) = 4.88277 eV ==== + psi = 0.041*[# 6]+0.041*[# 8]+0.041*[# 14]+0.041*[# 15]+0.041*[# 31] + +0.041*[# 32]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12]+0.024*[# 18] + +0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23]+0.024*[# 24] + +0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30]+0.004*[# 1]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.001*[# 5]+0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.588 + + k = 0.1666666667 0.5000000000 0.6666666667 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.017*[# 6]+0.017*[# 8] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19]+0.010*[# 20] + +0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26]+0.010*[# 27] + +0.010*[# 28]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 0.950 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.911 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15] + +0.008*[# 31]+0.008*[# 32]+0.007*[# 10]+0.007*[# 11]+0.007*[# 12] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.867 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.029*[# 10] + +0.029*[# 11]+0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.025*[# 2]+0.025*[# 3]+0.025*[# 4]+0.025*[# 7] + +0.025*[# 16]+0.025*[# 30] + |psi|^2 = 1.088 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.037*[# 7]+0.037*[# 16]+0.037*[# 30] + +0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.019*[# 1]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.987 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.039*[# 6]+0.039*[# 8]+0.039*[# 14]+0.039*[# 15]+0.039*[# 31] + +0.039*[# 32]+0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.033*[# 2] + +0.033*[# 3]+0.033*[# 4]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.012*[# 7] + +0.012*[# 16]+0.012*[# 30] + |psi|^2 = 1.084 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 7]+0.049*[# 16] + +0.049*[# 30]+0.045*[# 10]+0.045*[# 11]+0.045*[# 12]+0.045*[# 18] + +0.045*[# 19]+0.045*[# 20]+0.045*[# 22]+0.045*[# 23]+0.045*[# 24] + +0.045*[# 26]+0.045*[# 27]+0.045*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.029*[# 1] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 1.196 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 1.047 +==== e( 12) = 3.70168 eV ==== + psi = 0.073*[# 2]+0.073*[# 3]+0.073*[# 4]+0.056*[# 6]+0.056*[# 8] + +0.056*[# 14]+0.056*[# 15]+0.056*[# 31]+0.056*[# 32]+0.047*[# 10] + +0.047*[# 11]+0.047*[# 12]+0.047*[# 18]+0.047*[# 19]+0.047*[# 20] + +0.047*[# 22]+0.047*[# 23]+0.047*[# 24]+0.047*[# 26]+0.047*[# 27] + +0.047*[# 28]+0.028*[# 1]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.010*[# 5]+0.010*[# 13]+0.010*[# 29]+0.005*[# 7] + +0.005*[# 16]+0.005*[# 30] + |psi|^2 = 1.251 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.989 +==== e( 14) = 4.17314 eV ==== + psi = 0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.002*[# 1] + + |psi|^2 = 0.677 +==== e( 15) = 4.84656 eV ==== + psi = 0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.879 +==== e( 16) = 4.84692 eV ==== + psi = 0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 18] + +0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23]+0.023*[# 24] + +0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30]+0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.566 + + k = 0.3333333333 0.5000000000 0.6666666667 +==== e( 1) = -3.94104 eV ==== + psi = 0.122*[# 5]+0.122*[# 13]+0.122*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.94002 eV ==== + psi = 0.182*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.061*[# 5]+0.061*[# 13]+0.061*[# 29]+0.016*[# 6]+0.016*[# 8] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 31]+0.016*[# 32]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20] + +0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27] + +0.011*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.994 +==== e( 3) = -3.23789 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.094*[# 9]+0.094*[# 17] + +0.094*[# 21]+0.094*[# 25]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14] + +0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18] + +0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24] + +0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.962 +==== e( 4) = -3.23693 eV ==== + psi = 0.189*[# 1]+0.094*[# 9]+0.094*[# 17]+0.094*[# 21]+0.094*[# 25] + +0.063*[# 5]+0.063*[# 13]+0.063*[# 29]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30]+0.010*[# 2]+0.010*[# 3]+0.010*[# 4]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19]+0.009*[# 20] + +0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26]+0.009*[# 27] + +0.009*[# 28]+0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15] + +0.006*[# 31]+0.006*[# 32] + |psi|^2 = 0.962 +==== e( 5) = -0.73636 eV ==== + psi = 0.073*[# 1]+0.058*[# 7]+0.058*[# 16]+0.058*[# 30]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.024*[# 5]+0.024*[# 13]+0.024*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.018*[# 2] + +0.018*[# 3]+0.018*[# 4] + |psi|^2 = 0.989 +==== e( 6) = -0.73621 eV ==== + psi = 0.048*[# 5]+0.048*[# 13]+0.048*[# 29]+0.038*[# 6]+0.038*[# 8] + +0.038*[# 14]+0.038*[# 15]+0.038*[# 31]+0.038*[# 32]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 7]+0.020*[# 16] + +0.020*[# 30] + |psi|^2 = 0.989 +==== e( 7) = 0.03076 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.039*[# 9]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.038*[# 2]+0.038*[# 3]+0.038*[# 4] + +0.036*[# 7]+0.036*[# 16]+0.036*[# 30]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.016*[# 1] + |psi|^2 = 0.996 +==== e( 8) = 0.03135 eV ==== + psi = 0.062*[# 1]+0.039*[# 9]+0.039*[# 17]+0.039*[# 21]+0.039*[# 25] + +0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 14]+0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.031*[# 5] + +0.031*[# 13]+0.031*[# 29]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12] + +0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23] + +0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.001*[# 7] + +0.001*[# 16]+0.001*[# 30] + |psi|^2 = 0.996 +==== e( 9) = 3.53934 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.990 +==== e( 10) = 3.54036 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 7]+0.040*[# 16] + +0.040*[# 30]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 1]+0.031*[# 6] + +0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32] + +0.017*[# 9]+0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.012*[# 5] + +0.012*[# 13]+0.012*[# 29] + |psi|^2 = 0.990 +==== e( 11) = 4.50427 eV ==== + psi = 0.071*[# 6]+0.071*[# 8]+0.071*[# 14]+0.071*[# 15]+0.071*[# 31] + +0.071*[# 32]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.004*[# 7]+0.004*[# 16]+0.004*[# 30] + |psi|^2 = 1.149 +==== e( 12) = 4.50435 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.064*[# 7]+0.064*[# 16] + +0.064*[# 30]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32] + |psi|^2 = 1.149 +==== e( 13) = 4.57402 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.024*[# 1]+0.017*[# 2] + +0.017*[# 3]+0.017*[# 4]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29] + |psi|^2 = 0.987 +==== e( 14) = 4.57418 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.059*[# 7]+0.059*[# 16] + +0.059*[# 30]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.016*[# 5]+0.016*[# 13] + +0.016*[# 29]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25] + |psi|^2 = 0.987 +==== e( 15) = 4.74870 eV ==== + psi = 0.049*[# 7]+0.049*[# 16]+0.049*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 31] + +0.027*[# 32]+0.005*[# 2]+0.005*[# 3]+0.005*[# 4] + |psi|^2 = 0.648 +==== e( 16) = 4.74983 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31] + +0.027*[# 32]+0.008*[# 7]+0.008*[# 16]+0.008*[# 30] + |psi|^2 = 0.648 + + k = 0.5000000000 0.5000000000 0.6666666667 +==== e( 1) = -3.56633 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.009*[# 2]+0.009*[# 3]+0.009*[# 4] + +0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15]+0.007*[# 31] + +0.007*[# 32] + |psi|^2 = 0.995 +==== e( 2) = -3.56624 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15]+0.015*[# 31] + +0.015*[# 32]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12]+0.011*[# 18] + +0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24] + +0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + |psi|^2 = 1.028 +==== e( 3) = -3.56624 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.095*[# 9]+0.095*[# 17] + +0.095*[# 21]+0.095*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15]+0.012*[# 31] + +0.012*[# 32]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28] + |psi|^2 = 0.995 +==== e( 4) = -3.56434 eV ==== + psi = 0.377*[# 1]+0.095*[# 9]+0.095*[# 17]+0.095*[# 21]+0.095*[# 25] + +0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.009*[# 2]+0.009*[# 3]+0.009*[# 4]+0.008*[# 6]+0.008*[# 8] + +0.008*[# 14]+0.008*[# 15]+0.008*[# 31]+0.008*[# 32] + |psi|^2 = 1.028 +==== e( 5) = -0.56737 eV ==== + psi = 0.107*[# 7]+0.107*[# 16]+0.107*[# 30]+0.058*[# 1]+0.035*[# 9] + +0.035*[# 17]+0.035*[# 21]+0.035*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.028*[# 5]+0.028*[# 13]+0.028*[# 29]+0.005*[# 2]+0.005*[# 3] + +0.005*[# 4]+0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.988 +==== e( 6) = -0.56683 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 31]+0.037*[# 32]+0.035*[# 9]+0.035*[# 17]+0.035*[# 21] + +0.035*[# 25]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + |psi|^2 = 0.949 +==== e( 7) = -0.56683 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.037*[# 2] + +0.037*[# 3]+0.037*[# 4]+0.035*[# 9]+0.035*[# 17]+0.035*[# 21] + +0.035*[# 25]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + |psi|^2 = 0.988 +==== e( 8) = -0.56653 eV ==== + psi = 0.084*[# 1]+0.035*[# 9]+0.035*[# 17]+0.035*[# 21]+0.035*[# 25] + +0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.023*[# 7]+0.023*[# 16] + +0.023*[# 30]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.019*[# 2] + +0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.949 +==== e( 9) = 4.26946 eV ==== + psi = 0.142*[# 7]+0.142*[# 16]+0.142*[# 30]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.015*[# 5]+0.015*[# 13]+0.015*[# 29]+0.011*[# 9]+0.011*[# 17] + +0.011*[# 21]+0.011*[# 25]+0.003*[# 6]+0.003*[# 8]+0.003*[# 14] + +0.003*[# 15]+0.003*[# 31]+0.003*[# 32]+0.001*[# 2]+0.001*[# 3] + +0.001*[# 4] + |psi|^2 = 0.988 +==== e( 10) = 4.27017 eV ==== + psi = 0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.022*[# 10] + +0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20] + +0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27] + +0.022*[# 28]+0.015*[# 5]+0.015*[# 13]+0.015*[# 29]+0.011*[# 9] + +0.011*[# 17]+0.011*[# 21]+0.011*[# 25] + |psi|^2 = 0.612 +==== e( 11) = 4.27017 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.029*[# 2]+0.029*[# 3] + +0.029*[# 4]+0.015*[# 5]+0.015*[# 13]+0.015*[# 29]+0.011*[# 9] + +0.011*[# 17]+0.011*[# 21]+0.011*[# 25] + |psi|^2 = 0.988 +==== e( 12) = 4.27105 eV ==== + psi = 0.046*[# 1]+0.029*[# 7]+0.029*[# 16]+0.029*[# 30]+0.026*[# 6] + +0.026*[# 8]+0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32] + +0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19] + +0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26] + +0.022*[# 27]+0.022*[# 28]+0.011*[# 9]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.612 +==== e( 13) = 4.92638 eV ==== + psi = 0.164*[# 7]+0.164*[# 16]+0.164*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.988 +==== e( 14) = 4.92678 eV ==== + psi = 0.123*[# 6]+0.123*[# 8]+0.123*[# 14]+0.123*[# 15]+0.123*[# 31] + +0.123*[# 32]+0.062*[# 10]+0.062*[# 11]+0.062*[# 12]+0.062*[# 18] + +0.062*[# 19]+0.062*[# 20]+0.062*[# 22]+0.062*[# 23]+0.062*[# 24] + +0.062*[# 26]+0.062*[# 27]+0.062*[# 28] + |psi|^2 = 1.482 +==== e( 15) = 4.92770 eV ==== + psi = 0.082*[# 2]+0.082*[# 3]+0.082*[# 4]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14]+0.041*[# 15] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.041*[# 31] + +0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 4.92770 eV ==== + psi = 0.082*[# 2]+0.082*[# 3]+0.082*[# 4]+0.082*[# 6]+0.082*[# 8] + +0.082*[# 14]+0.082*[# 15]+0.082*[# 31]+0.082*[# 32]+0.062*[# 10] + +0.062*[# 11]+0.062*[# 12]+0.062*[# 18]+0.062*[# 19]+0.062*[# 20] + +0.062*[# 22]+0.062*[# 23]+0.062*[# 24]+0.062*[# 26]+0.062*[# 27] + +0.062*[# 28] + |psi|^2 = 1.482 + + k = 0.6666666667 0.5000000000 0.6666666667 +==== e( 1) = -3.94104 eV ==== + psi = 0.122*[# 5]+0.122*[# 13]+0.122*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.94002 eV ==== + psi = 0.182*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.061*[# 5]+0.061*[# 13]+0.061*[# 29]+0.016*[# 6]+0.016*[# 8] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 31]+0.016*[# 32]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20] + +0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27] + +0.011*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.994 +==== e( 3) = -3.23789 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.094*[# 9]+0.094*[# 17] + +0.094*[# 21]+0.094*[# 25]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14] + +0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18] + +0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24] + +0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.962 +==== e( 4) = -3.23693 eV ==== + psi = 0.189*[# 1]+0.094*[# 9]+0.094*[# 17]+0.094*[# 21]+0.094*[# 25] + +0.063*[# 5]+0.063*[# 13]+0.063*[# 29]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30]+0.010*[# 2]+0.010*[# 3]+0.010*[# 4]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19]+0.009*[# 20] + +0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26]+0.009*[# 27] + +0.009*[# 28]+0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15] + +0.006*[# 31]+0.006*[# 32] + |psi|^2 = 0.962 +==== e( 5) = -0.73636 eV ==== + psi = 0.073*[# 1]+0.058*[# 7]+0.058*[# 16]+0.058*[# 30]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.024*[# 5]+0.024*[# 13]+0.024*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.018*[# 2] + +0.018*[# 3]+0.018*[# 4] + |psi|^2 = 0.989 +==== e( 6) = -0.73621 eV ==== + psi = 0.048*[# 5]+0.048*[# 13]+0.048*[# 29]+0.038*[# 6]+0.038*[# 8] + +0.038*[# 14]+0.038*[# 15]+0.038*[# 31]+0.038*[# 32]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 7]+0.020*[# 16] + +0.020*[# 30] + |psi|^2 = 0.989 +==== e( 7) = 0.03076 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.039*[# 9]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.038*[# 2]+0.038*[# 3]+0.038*[# 4] + +0.036*[# 7]+0.036*[# 16]+0.036*[# 30]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.016*[# 1] + |psi|^2 = 0.996 +==== e( 8) = 0.03135 eV ==== + psi = 0.062*[# 1]+0.039*[# 9]+0.039*[# 17]+0.039*[# 21]+0.039*[# 25] + +0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 14]+0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.031*[# 5] + +0.031*[# 13]+0.031*[# 29]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12] + +0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23] + +0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.001*[# 7] + +0.001*[# 16]+0.001*[# 30] + |psi|^2 = 0.996 +==== e( 9) = 3.53934 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.990 +==== e( 10) = 3.54036 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 7]+0.040*[# 16] + +0.040*[# 30]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 1]+0.031*[# 6] + +0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32] + +0.017*[# 9]+0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.012*[# 5] + +0.012*[# 13]+0.012*[# 29] + |psi|^2 = 0.990 +==== e( 11) = 4.50427 eV ==== + psi = 0.071*[# 6]+0.071*[# 8]+0.071*[# 14]+0.071*[# 15]+0.071*[# 31] + +0.071*[# 32]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.004*[# 7]+0.004*[# 16]+0.004*[# 30] + |psi|^2 = 1.149 +==== e( 12) = 4.50435 eV ==== + psi = 0.079*[# 2]+0.079*[# 3]+0.079*[# 4]+0.064*[# 7]+0.064*[# 16] + +0.064*[# 30]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32] + |psi|^2 = 1.149 +==== e( 13) = 4.57402 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.024*[# 1]+0.017*[# 2] + +0.017*[# 3]+0.017*[# 4]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29] + |psi|^2 = 0.987 +==== e( 14) = 4.57418 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.059*[# 7]+0.059*[# 16] + +0.059*[# 30]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.016*[# 5]+0.016*[# 13] + +0.016*[# 29]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25] + |psi|^2 = 0.987 +==== e( 15) = 4.74870 eV ==== + psi = 0.049*[# 7]+0.049*[# 16]+0.049*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 31] + +0.027*[# 32]+0.005*[# 2]+0.005*[# 3]+0.005*[# 4] + |psi|^2 = 0.648 +==== e( 16) = 4.74983 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31] + +0.027*[# 32]+0.008*[# 7]+0.008*[# 16]+0.008*[# 30] + |psi|^2 = 0.648 + + k = 0.8333333333 0.5000000000 0.6666666667 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.017*[# 6]+0.017*[# 8] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19]+0.010*[# 20] + +0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26]+0.010*[# 27] + +0.010*[# 28]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4]+0.003*[# 7] + +0.003*[# 16]+0.003*[# 30] + |psi|^2 = 0.950 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.911 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15] + +0.008*[# 31]+0.008*[# 32]+0.007*[# 10]+0.007*[# 11]+0.007*[# 12] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.003*[# 2] + +0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.867 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.029*[# 10] + +0.029*[# 11]+0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20] + +0.029*[# 22]+0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27] + +0.029*[# 28]+0.025*[# 2]+0.025*[# 3]+0.025*[# 4]+0.025*[# 7] + +0.025*[# 16]+0.025*[# 30] + |psi|^2 = 1.088 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.037*[# 7]+0.037*[# 16]+0.037*[# 30] + +0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.019*[# 1]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.987 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.039*[# 6]+0.039*[# 8]+0.039*[# 14]+0.039*[# 15]+0.039*[# 31] + +0.039*[# 32]+0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.033*[# 2] + +0.033*[# 3]+0.033*[# 4]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.012*[# 7] + +0.012*[# 16]+0.012*[# 30] + |psi|^2 = 1.084 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 7]+0.049*[# 16] + +0.049*[# 30]+0.045*[# 10]+0.045*[# 11]+0.045*[# 12]+0.045*[# 18] + +0.045*[# 19]+0.045*[# 20]+0.045*[# 22]+0.045*[# 23]+0.045*[# 24] + +0.045*[# 26]+0.045*[# 27]+0.045*[# 28]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.029*[# 1] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 1.196 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 1.047 +==== e( 12) = 3.70168 eV ==== + psi = 0.073*[# 2]+0.073*[# 3]+0.073*[# 4]+0.056*[# 6]+0.056*[# 8] + +0.056*[# 14]+0.056*[# 15]+0.056*[# 31]+0.056*[# 32]+0.047*[# 10] + +0.047*[# 11]+0.047*[# 12]+0.047*[# 18]+0.047*[# 19]+0.047*[# 20] + +0.047*[# 22]+0.047*[# 23]+0.047*[# 24]+0.047*[# 26]+0.047*[# 27] + +0.047*[# 28]+0.028*[# 1]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.010*[# 5]+0.010*[# 13]+0.010*[# 29]+0.005*[# 7] + +0.005*[# 16]+0.005*[# 30] + |psi|^2 = 1.251 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.002*[# 1] + + |psi|^2 = 0.677 +==== e( 15) = 4.84656 eV ==== + psi = 0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.879 +==== e( 16) = 4.84692 eV ==== + psi = 0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 18] + +0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23]+0.023*[# 24] + +0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30]+0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.566 + + k = 0.0000000000 0.6666666667 0.6666666667 +==== e( 1) = -4.87592 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.52951 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15]+0.009*[# 31] + +0.009*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.002*[# 7]+0.002*[# 16] + +0.002*[# 30] + |psi|^2 = 0.848 +==== e( 3) = -3.52873 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.056*[# 5]+0.056*[# 13]+0.056*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.54529 eV ==== + psi = 0.085*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.085*[# 5]+0.085*[# 13]+0.085*[# 29]+0.011*[# 7]+0.011*[# 16] + +0.011*[# 30]+0.010*[# 6]+0.010*[# 8]+0.010*[# 10]+0.010*[# 11] + +0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.010*[# 31]+0.010*[# 32]+0.009*[# 2] + +0.009*[# 3]+0.009*[# 4] + |psi|^2 = 0.929 +==== e( 5) = -0.62188 eV ==== + psi = 0.063*[# 1]+0.063*[# 5]+0.063*[# 9]+0.063*[# 13]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.063*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.994 +==== e( 6) = 0.50951 eV ==== + psi = 0.081*[# 5]+0.081*[# 13]+0.081*[# 29]+0.061*[# 9]+0.061*[# 17] + +0.061*[# 21]+0.061*[# 25]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.016*[# 7]+0.016*[# 16] + +0.016*[# 30] + |psi|^2 = 1.178 +==== e( 7) = 0.50974 eV ==== + psi = 0.122*[# 1]+0.061*[# 9]+0.061*[# 17]+0.061*[# 21]+0.061*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.029*[# 2]+0.029*[# 3] + +0.029*[# 4]+0.029*[# 7]+0.029*[# 16]+0.029*[# 30]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.992 +==== e( 8) = 1.69051 eV ==== + psi = 0.045*[# 7]+0.045*[# 16]+0.045*[# 30]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.002*[# 1] + +0.002*[# 5]+0.002*[# 9]+0.002*[# 13]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25]+0.002*[# 29] + |psi|^2 = 0.892 +==== e( 9) = 2.43371 eV ==== + psi = 0.043*[# 5]+0.043*[# 9]+0.043*[# 13]+0.043*[# 17]+0.043*[# 21] + +0.043*[# 25]+0.043*[# 29]+0.043*[# 1]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 0.987 +==== e( 10) = 2.54749 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.049*[# 2]+0.049*[# 3] + +0.049*[# 4]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.015*[# 1] + +0.008*[# 9]+0.008*[# 17]+0.008*[# 21]+0.008*[# 25]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29] + |psi|^2 = 0.981 +==== e( 11) = 2.54759 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29]+0.008*[# 9]+0.008*[# 17]+0.008*[# 21] + +0.008*[# 25] + |psi|^2 = 0.992 +==== e( 12) = 3.71718 eV ==== + psi = 0.070*[# 2]+0.070*[# 3]+0.070*[# 4]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 14]+0.050*[# 15] + +0.050*[# 18]+0.050*[# 19]+0.050*[# 20]+0.050*[# 22]+0.050*[# 23] + +0.050*[# 24]+0.050*[# 26]+0.050*[# 27]+0.050*[# 28]+0.050*[# 31] + +0.050*[# 32]+0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.277 +==== e( 13) = 3.84161 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.050*[# 6]+0.050*[# 8] + +0.050*[# 14]+0.050*[# 15]+0.050*[# 31]+0.050*[# 32]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.002*[# 5]+0.002*[# 13]+0.002*[# 29]+0.001*[# 9] + +0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.990 +==== e( 14) = 3.84259 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.036*[# 7]+0.036*[# 16] + +0.036*[# 30]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 18] + +0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23]+0.034*[# 24] + +0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.003*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.822 +==== e( 15) = 4.03675 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.878 +==== e( 16) = 5.60339 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.029*[# 6]+0.029*[# 8] + +0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 14]+0.029*[# 15] + +0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23] + +0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.029*[# 31] + +0.029*[# 32]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30] + |psi|^2 = 0.705 + + k = 0.1666666667 0.6666666667 0.6666666667 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15]+0.010*[# 31] + +0.010*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.883 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30]+0.011*[# 6]+0.011*[# 8]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 18]+0.011*[# 19] + +0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26] + +0.011*[# 27]+0.011*[# 28]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2] + +0.009*[# 3]+0.009*[# 4] + |psi|^2 = 0.963 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.013*[# 7]+0.013*[# 16] + +0.013*[# 30] + |psi|^2 = 1.093 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.019*[# 2] + +0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.991 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.031*[# 2]+0.031*[# 3] + +0.031*[# 4]+0.025*[# 7]+0.025*[# 16]+0.025*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 1.160 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.055*[# 7]+0.055*[# 16]+0.055*[# 30]+0.055*[# 6]+0.055*[# 8] + +0.055*[# 14]+0.055*[# 15]+0.055*[# 31]+0.055*[# 32]+0.042*[# 10] + +0.042*[# 11]+0.042*[# 12]+0.042*[# 18]+0.042*[# 19]+0.042*[# 20] + +0.042*[# 22]+0.042*[# 23]+0.042*[# 24]+0.042*[# 26]+0.042*[# 27] + +0.042*[# 28]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4] + |psi|^2 = 1.016 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.034*[# 6]+0.034*[# 8] + +0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.804 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.020*[# 6]+0.020*[# 7] + +0.020*[# 8]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 14] + +0.020*[# 15]+0.020*[# 16]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.020*[# 30]+0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.492 + + k = 0.3333333333 0.6666666667 0.6666666667 +==== e( 1) = -4.44567 eV ==== + psi = 0.093*[# 5]+0.093*[# 9]+0.093*[# 13]+0.093*[# 17]+0.093*[# 21] + +0.093*[# 25]+0.093*[# 29]+0.092*[# 1]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4]+0.011*[# 6]+0.011*[# 7]+0.011*[# 8]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 16] + +0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23] + +0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.011*[# 30] + +0.011*[# 31]+0.011*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14] + +0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.005*[# 7]+0.005*[# 16] + +0.005*[# 30] + |psi|^2 = 0.962 +==== e( 3) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + +0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15]+0.014*[# 31] + +0.014*[# 32]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12]+0.014*[# 18] + +0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24] + +0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 1.051 +==== e( 4) = -3.32159 eV ==== + psi = 0.272*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.030*[# 5]+0.030*[# 13]+0.030*[# 29]+0.017*[# 7]+0.017*[# 16] + +0.017*[# 30]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 14]+0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.009*[# 2] + +0.009*[# 3]+0.009*[# 4] + |psi|^2 = 1.006 +==== e( 5) = -0.47745 eV ==== + psi = 0.124*[# 1]+0.081*[# 7]+0.081*[# 16]+0.081*[# 30]+0.041*[# 9] + +0.041*[# 17]+0.041*[# 21]+0.041*[# 25]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.014*[# 5]+0.014*[# 13]+0.014*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.990 +==== e( 6) = -0.47735 eV ==== + psi = 0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.045*[# 6]+0.045*[# 8] + +0.045*[# 14]+0.045*[# 15]+0.045*[# 31]+0.045*[# 32]+0.041*[# 9] + +0.041*[# 17]+0.041*[# 21]+0.041*[# 25]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.991 +==== e( 7) = -0.47735 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.055*[# 5]+0.055*[# 13] + +0.055*[# 29]+0.041*[# 9]+0.041*[# 17]+0.041*[# 21]+0.041*[# 25] + +0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19] + +0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26] + +0.027*[# 27]+0.027*[# 28]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14] + +0.025*[# 15]+0.025*[# 31]+0.025*[# 32] + |psi|^2 = 0.988 +==== e( 8) = 0.79675 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.028*[# 2] + +0.028*[# 3]+0.028*[# 4]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12] + +0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23] + +0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.022*[# 7] + +0.022*[# 16]+0.022*[# 30] + |psi|^2 = 0.983 +==== e( 9) = 3.35691 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4] + |psi|^2 = 0.991 +==== e( 10) = 3.35691 eV ==== + psi = 0.062*[# 7]+0.062*[# 16]+0.062*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4] + |psi|^2 = 1.077 +==== e( 11) = 3.35799 eV ==== + psi = 0.058*[# 2]+0.058*[# 3]+0.058*[# 4]+0.052*[# 1]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28]+0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15] + +0.029*[# 31]+0.029*[# 32]+0.017*[# 9]+0.017*[# 17]+0.017*[# 21] + +0.017*[# 25]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 0.918 +==== e( 12) = 4.37538 eV ==== + psi = 0.072*[# 6]+0.072*[# 8]+0.072*[# 14]+0.072*[# 15]+0.072*[# 31] + +0.072*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.932 +==== e( 13) = 4.37596 eV ==== + psi = 0.062*[# 7]+0.062*[# 16]+0.062*[# 30]+0.062*[# 2]+0.062*[# 3] + +0.062*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.990 +==== e( 14) = 4.37596 eV ==== + psi = 0.077*[# 2]+0.077*[# 3]+0.077*[# 4]+0.057*[# 7]+0.057*[# 16] + +0.057*[# 30]+0.046*[# 10]+0.046*[# 11]+0.046*[# 12]+0.046*[# 18] + +0.046*[# 19]+0.046*[# 20]+0.046*[# 22]+0.046*[# 23]+0.046*[# 24] + +0.046*[# 26]+0.046*[# 27]+0.046*[# 28]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32] + |psi|^2 = 1.115 +==== e( 15) = 5.16112 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.046*[# 7]+0.046*[# 10] + +0.046*[# 11]+0.046*[# 12]+0.046*[# 16]+0.046*[# 18]+0.046*[# 19] + +0.046*[# 20]+0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26] + +0.046*[# 27]+0.046*[# 28]+0.046*[# 30]+0.046*[# 6]+0.046*[# 8] + +0.046*[# 14]+0.046*[# 15]+0.046*[# 31]+0.046*[# 32] + |psi|^2 = 1.104 +==== e( 16) = 5.16112 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.028*[# 7]+0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.745 + + k = 0.5000000000 0.6666666667 0.6666666667 +==== e( 1) = -3.94104 eV ==== + psi = 0.122*[# 5]+0.122*[# 13]+0.122*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.017*[# 7]+0.017*[# 16]+0.017*[# 30] + +0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.006*[# 6]+0.006*[# 8]+0.006*[# 14]+0.006*[# 15]+0.006*[# 31] + +0.006*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.94002 eV ==== + psi = 0.182*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.061*[# 5]+0.061*[# 13]+0.061*[# 29]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.015*[# 2] + +0.015*[# 3]+0.015*[# 4]+0.014*[# 10]+0.014*[# 11]+0.014*[# 12] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.004*[# 7] + +0.004*[# 16]+0.004*[# 30] + |psi|^2 = 1.079 +==== e( 3) = -3.23789 eV ==== + psi = 0.126*[# 5]+0.126*[# 13]+0.126*[# 29]+0.094*[# 9]+0.094*[# 17] + +0.094*[# 21]+0.094*[# 25]+0.011*[# 6]+0.011*[# 8]+0.011*[# 14] + +0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18] + +0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24] + +0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.962 +==== e( 4) = -3.23693 eV ==== + psi = 0.189*[# 1]+0.094*[# 9]+0.094*[# 17]+0.094*[# 21]+0.094*[# 25] + +0.063*[# 5]+0.063*[# 13]+0.063*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 14]+0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.008*[# 2] + +0.008*[# 3]+0.008*[# 4] + |psi|^2 = 1.047 +==== e( 5) = -0.73636 eV ==== + psi = 0.073*[# 1]+0.058*[# 7]+0.058*[# 16]+0.058*[# 30]+0.036*[# 9] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.024*[# 5]+0.024*[# 13]+0.024*[# 29]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.018*[# 2] + +0.018*[# 3]+0.018*[# 4] + |psi|^2 = 0.989 +==== e( 6) = -0.73621 eV ==== + psi = 0.048*[# 5]+0.048*[# 13]+0.048*[# 29]+0.038*[# 2]+0.038*[# 3] + +0.038*[# 4]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 31]+0.037*[# 32]+0.036*[# 9]+0.036*[# 17]+0.036*[# 21] + +0.036*[# 25]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + |psi|^2 = 0.963 +==== e( 7) = 0.03076 eV ==== + psi = 0.047*[# 5]+0.047*[# 13]+0.047*[# 29]+0.039*[# 9]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.038*[# 2]+0.038*[# 3]+0.038*[# 4] + +0.036*[# 7]+0.036*[# 16]+0.036*[# 30]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.016*[# 1] + |psi|^2 = 0.996 +==== e( 8) = 0.03135 eV ==== + psi = 0.062*[# 1]+0.039*[# 9]+0.039*[# 17]+0.039*[# 21]+0.039*[# 25] + +0.036*[# 6]+0.036*[# 8]+0.036*[# 14]+0.036*[# 15]+0.036*[# 31] + +0.036*[# 32]+0.031*[# 5]+0.031*[# 13]+0.031*[# 29]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20] + +0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27] + +0.027*[# 28]+0.019*[# 2]+0.019*[# 3]+0.019*[# 4]+0.019*[# 7] + +0.019*[# 16]+0.019*[# 30] + |psi|^2 = 0.970 +==== e( 9) = 3.53934 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4] + |psi|^2 = 0.990 +==== e( 10) = 3.54036 eV ==== + psi = 0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.035*[# 1]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15] + +0.020*[# 31]+0.020*[# 32]+0.019*[# 7]+0.019*[# 16]+0.019*[# 30] + +0.017*[# 9]+0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.012*[# 5] + +0.012*[# 13]+0.012*[# 29] + |psi|^2 = 0.728 +==== e( 11) = 4.50427 eV ==== + psi = 0.071*[# 6]+0.071*[# 8]+0.071*[# 14]+0.071*[# 15]+0.071*[# 31] + +0.071*[# 32]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 18] + +0.048*[# 19]+0.048*[# 20]+0.048*[# 22]+0.048*[# 23]+0.048*[# 24] + +0.048*[# 26]+0.048*[# 27]+0.048*[# 28]+0.044*[# 2]+0.044*[# 3] + +0.044*[# 4]+0.004*[# 7]+0.004*[# 16]+0.004*[# 30] + |psi|^2 = 1.149 +==== e( 12) = 4.50435 eV ==== + psi = 0.063*[# 7]+0.063*[# 16]+0.063*[# 30]+0.058*[# 2]+0.058*[# 3] + +0.058*[# 4]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.013*[# 6]+0.013*[# 8] + +0.013*[# 14]+0.013*[# 15]+0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.887 +==== e( 13) = 4.57402 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.024*[# 1]+0.017*[# 2] + +0.017*[# 3]+0.017*[# 4]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25]+0.011*[# 7]+0.011*[# 16]+0.011*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29] + |psi|^2 = 0.987 +==== e( 14) = 4.57418 eV ==== + psi = 0.101*[# 7]+0.101*[# 16]+0.101*[# 30]+0.055*[# 10]+0.055*[# 11] + +0.055*[# 12]+0.055*[# 18]+0.055*[# 19]+0.055*[# 20]+0.055*[# 22] + +0.055*[# 23]+0.055*[# 24]+0.055*[# 26]+0.055*[# 27]+0.055*[# 28] + +0.055*[# 2]+0.055*[# 3]+0.055*[# 4]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.016*[# 5] + +0.016*[# 13]+0.016*[# 29]+0.012*[# 9]+0.012*[# 17]+0.012*[# 21] + +0.012*[# 25] + |psi|^2 = 1.414 +==== e( 15) = 4.74870 eV ==== + psi = 0.049*[# 7]+0.049*[# 16]+0.049*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 31] + +0.027*[# 32]+0.005*[# 2]+0.005*[# 3]+0.005*[# 4] + |psi|^2 = 0.648 +==== e( 16) = 4.74983 eV ==== + psi = 0.090*[# 2]+0.090*[# 3]+0.090*[# 4]+0.045*[# 10]+0.045*[# 11] + +0.045*[# 12]+0.045*[# 18]+0.045*[# 19]+0.045*[# 20]+0.045*[# 22] + +0.045*[# 23]+0.045*[# 24]+0.045*[# 26]+0.045*[# 27]+0.045*[# 28] + +0.044*[# 6]+0.044*[# 8]+0.044*[# 14]+0.044*[# 15]+0.044*[# 31] + +0.044*[# 32]+0.001*[# 7]+0.001*[# 16]+0.001*[# 30] + |psi|^2 = 1.075 + + k = 0.6666666667 0.6666666667 0.6666666667 +==== e( 1) = -4.44567 eV ==== + psi = 0.093*[# 5]+0.093*[# 9]+0.093*[# 13]+0.093*[# 17]+0.093*[# 21] + +0.093*[# 25]+0.093*[# 29]+0.092*[# 1]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4]+0.011*[# 6]+0.011*[# 7]+0.011*[# 8]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 16] + +0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23] + +0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.011*[# 30] + +0.011*[# 31]+0.011*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.012*[# 2]+0.012*[# 3]+0.012*[# 4] + +0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15]+0.012*[# 31] + +0.012*[# 32]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12]+0.011*[# 18] + +0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24] + +0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.980 +==== e( 3) = -3.32293 eV ==== + psi = 0.121*[# 5]+0.121*[# 13]+0.121*[# 29]+0.091*[# 9]+0.091*[# 17] + +0.091*[# 21]+0.091*[# 25]+0.016*[# 2]+0.016*[# 3]+0.016*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.005*[# 7]+0.005*[# 16] + +0.005*[# 30] + |psi|^2 = 1.013 +==== e( 4) = -3.32159 eV ==== + psi = 0.272*[# 1]+0.091*[# 9]+0.091*[# 17]+0.091*[# 21]+0.091*[# 25] + +0.030*[# 5]+0.030*[# 13]+0.030*[# 29]+0.017*[# 7]+0.017*[# 16] + +0.017*[# 30]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 14]+0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4] + |psi|^2 = 1.008 +==== e( 5) = -0.47745 eV ==== + psi = 0.124*[# 1]+0.081*[# 7]+0.081*[# 16]+0.081*[# 30]+0.041*[# 9] + +0.041*[# 17]+0.041*[# 21]+0.041*[# 25]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.014*[# 5]+0.014*[# 13]+0.014*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.990 +==== e( 6) = -0.47735 eV ==== + psi = 0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.041*[# 9]+0.041*[# 17] + +0.041*[# 21]+0.041*[# 25]+0.039*[# 6]+0.039*[# 8]+0.039*[# 14] + +0.039*[# 15]+0.039*[# 31]+0.039*[# 32]+0.029*[# 2]+0.029*[# 3] + +0.029*[# 4]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.990 +==== e( 7) = -0.47735 eV ==== + psi = 0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.041*[# 9]+0.041*[# 17] + +0.041*[# 21]+0.041*[# 25]+0.039*[# 6]+0.039*[# 8]+0.039*[# 14] + +0.039*[# 15]+0.039*[# 31]+0.039*[# 32]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + |psi|^2 = 0.990 +==== e( 8) = 0.79675 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.028*[# 10] + +0.028*[# 11]+0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15] + +0.023*[# 31]+0.023*[# 32] + |psi|^2 = 0.982 +==== e( 9) = 3.35691 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.043*[# 6]+0.043*[# 8] + +0.043*[# 14]+0.043*[# 15]+0.043*[# 31]+0.043*[# 32]+0.035*[# 10] + +0.035*[# 11]+0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4] + |psi|^2 = 0.991 +==== e( 10) = 3.35691 eV ==== + psi = 0.070*[# 7]+0.070*[# 16]+0.070*[# 30]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.033*[# 6]+0.033*[# 8]+0.033*[# 14]+0.033*[# 15]+0.033*[# 31] + +0.033*[# 32]+0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.017*[# 9] + +0.017*[# 17]+0.017*[# 21]+0.017*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 1.024 +==== e( 11) = 3.35799 eV ==== + psi = 0.058*[# 2]+0.058*[# 3]+0.058*[# 4]+0.052*[# 1]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28]+0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15] + +0.029*[# 31]+0.029*[# 32]+0.017*[# 9]+0.017*[# 17]+0.017*[# 21] + +0.017*[# 25]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 0.908 +==== e( 12) = 4.37538 eV ==== + psi = 0.080*[# 6]+0.080*[# 8]+0.080*[# 14]+0.080*[# 15]+0.080*[# 31] + +0.080*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.005*[# 2]+0.005*[# 3] + +0.005*[# 4]+0.002*[# 7]+0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.994 +==== e( 13) = 4.37596 eV ==== + psi = 0.062*[# 7]+0.062*[# 16]+0.062*[# 30]+0.062*[# 2]+0.062*[# 3] + +0.062*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.990 +==== e( 14) = 4.37596 eV ==== + psi = 0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.034*[# 7]+0.034*[# 16]+0.034*[# 30]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32] + |psi|^2 = 0.836 +==== e( 15) = 5.16112 eV ==== + psi = 0.071*[# 2]+0.071*[# 3]+0.071*[# 4]+0.071*[# 7]+0.071*[# 16] + +0.071*[# 30]+0.054*[# 10]+0.054*[# 11]+0.054*[# 12]+0.054*[# 18] + +0.054*[# 19]+0.054*[# 20]+0.054*[# 22]+0.054*[# 23]+0.054*[# 24] + +0.054*[# 26]+0.054*[# 27]+0.054*[# 28]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 14]+0.037*[# 15]+0.037*[# 31]+0.037*[# 32] + |psi|^2 = 1.291 +==== e( 16) = 5.16112 eV ==== + psi = 0.045*[# 2]+0.045*[# 3]+0.045*[# 4]+0.035*[# 6]+0.035*[# 8] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14]+0.035*[# 15] + +0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23] + +0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 31] + +0.035*[# 32]+0.025*[# 7]+0.025*[# 16]+0.025*[# 30] + |psi|^2 = 0.837 + + k = 0.8333333333 0.6666666667 0.6666666667 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.010*[# 6]+0.010*[# 8]+0.010*[# 14]+0.010*[# 15]+0.010*[# 31] + +0.010*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.003*[# 7]+0.003*[# 16] + +0.003*[# 30] + |psi|^2 = 0.883 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30]+0.011*[# 6]+0.011*[# 8]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 14]+0.011*[# 15]+0.011*[# 18]+0.011*[# 19] + +0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26] + +0.011*[# 27]+0.011*[# 28]+0.011*[# 31]+0.011*[# 32]+0.009*[# 2] + +0.009*[# 3]+0.009*[# 4] + |psi|^2 = 0.963 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.037*[# 6]+0.037*[# 8]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 31]+0.037*[# 32]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.013*[# 7]+0.013*[# 16] + +0.013*[# 30] + |psi|^2 = 1.093 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.019*[# 2] + +0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.991 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.059*[# 6]+0.059*[# 8]+0.059*[# 14]+0.059*[# 15]+0.059*[# 31] + +0.059*[# 32]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.031*[# 2]+0.031*[# 3] + +0.031*[# 4]+0.025*[# 7]+0.025*[# 16]+0.025*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 1.160 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.055*[# 7]+0.055*[# 16]+0.055*[# 30]+0.055*[# 6]+0.055*[# 8] + +0.055*[# 14]+0.055*[# 15]+0.055*[# 31]+0.055*[# 32]+0.042*[# 10] + +0.042*[# 11]+0.042*[# 12]+0.042*[# 18]+0.042*[# 19]+0.042*[# 20] + +0.042*[# 22]+0.042*[# 23]+0.042*[# 24]+0.042*[# 26]+0.042*[# 27] + +0.042*[# 28]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4] + |psi|^2 = 1.016 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.034*[# 6]+0.034*[# 8] + +0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.804 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.020*[# 6]+0.020*[# 7] + +0.020*[# 8]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 14] + +0.020*[# 15]+0.020*[# 16]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.020*[# 30]+0.020*[# 31]+0.020*[# 32] + |psi|^2 = 0.492 + + k = 0.0000000000 0.8333333333 0.6666666667 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1] + |psi|^2 = 0.679 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.027*[# 6]+0.027*[# 7]+0.027*[# 8]+0.027*[# 10] + +0.027*[# 11]+0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 16] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.027*[# 30] + +0.027*[# 31]+0.027*[# 32] + |psi|^2 = 1.296 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.980 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 6]+0.032*[# 7]+0.032*[# 8]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15]+0.032*[# 16] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 30] + +0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.332 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.596 +==== e( 8) = 1.85450 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.032*[# 6]+0.032*[# 7] + +0.032*[# 8]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 14] + +0.032*[# 15]+0.032*[# 16]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28]+0.032*[# 30]+0.032*[# 31]+0.032*[# 32] + |psi|^2 = 0.767 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.042*[# 2]+0.042*[# 3]+0.042*[# 4]+0.042*[# 6]+0.042*[# 7] + +0.042*[# 8]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 14] + +0.042*[# 15]+0.042*[# 16]+0.042*[# 18]+0.042*[# 19]+0.042*[# 20] + +0.042*[# 22]+0.042*[# 23]+0.042*[# 24]+0.042*[# 26]+0.042*[# 27] + +0.042*[# 28]+0.042*[# 30]+0.042*[# 31]+0.042*[# 32] + |psi|^2 = 1.013 +==== e( 11) = 3.29155 eV ==== + psi = 0.055*[# 6]+0.055*[# 7]+0.055*[# 8]+0.055*[# 14]+0.055*[# 15] + +0.055*[# 16]+0.055*[# 31]+0.055*[# 32]+0.055*[# 10]+0.055*[# 12] + +0.055*[# 11]+0.055*[# 18]+0.055*[# 19]+0.055*[# 20]+0.055*[# 30] + +0.055*[# 22]+0.055*[# 23]+0.055*[# 24]+0.055*[# 26]+0.055*[# 27] + +0.055*[# 28]+0.054*[# 2]+0.054*[# 3]+0.054*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.349 +==== e( 12) = 3.36033 eV ==== + psi = 0.036*[# 2]+0.036*[# 3]+0.036*[# 4]+0.036*[# 7]+0.036*[# 16] + +0.036*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.036*[# 6]+0.036*[# 8] + +0.036*[# 14]+0.036*[# 15]+0.036*[# 31]+0.036*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.879 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.043*[# 2]+0.043*[# 3]+0.043*[# 4]+0.043*[# 7]+0.043*[# 16] + +0.043*[# 30]+0.043*[# 6]+0.043*[# 8]+0.043*[# 10]+0.043*[# 11] + +0.043*[# 12]+0.043*[# 14]+0.043*[# 15]+0.043*[# 18]+0.043*[# 19] + +0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24]+0.043*[# 26] + +0.043*[# 27]+0.043*[# 28]+0.043*[# 31]+0.043*[# 32] + |psi|^2 = 1.026 +==== e( 15) = 4.50839 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.009 +==== e( 16) = 5.45761 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.015 + + k = 0.1666666667 0.8333333333 0.6666666667 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.730 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.025*[# 31]+0.025*[# 32]+0.025*[# 7]+0.025*[# 16] + +0.025*[# 30] + |psi|^2 = 1.271 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 10]+0.014*[# 11] + +0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 18]+0.014*[# 19] + +0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26] + +0.014*[# 27]+0.014*[# 28]+0.014*[# 31]+0.014*[# 32]+0.013*[# 2] + +0.013*[# 3]+0.013*[# 4] + |psi|^2 = 0.990 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.041*[# 7]+0.041*[# 16] + +0.041*[# 30]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 18] + +0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24] + +0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.133 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.742 +==== e( 8) = 2.16363 eV ==== + psi = 0.043*[# 7]+0.043*[# 16]+0.043*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.899 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 7]+0.038*[# 16] + +0.038*[# 30]+0.036*[# 1]+0.036*[# 5]+0.036*[# 9]+0.036*[# 13] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.036*[# 29]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15] + +0.025*[# 31]+0.025*[# 32] + |psi|^2 = 1.049 +==== e( 11) = 3.13966 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.037*[# 6]+0.037*[# 7] + +0.037*[# 8]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 16]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.037*[# 30]+0.037*[# 31]+0.037*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.963 +==== e( 12) = 3.51483 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.756 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.054*[# 6]+0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31] + +0.054*[# 32]+0.052*[# 10]+0.052*[# 11]+0.052*[# 12]+0.052*[# 18] + +0.052*[# 19]+0.052*[# 20]+0.052*[# 22]+0.052*[# 23]+0.052*[# 24] + +0.052*[# 26]+0.052*[# 27]+0.052*[# 28]+0.050*[# 2]+0.050*[# 3] + +0.050*[# 4]+0.050*[# 7]+0.050*[# 16]+0.050*[# 30] + |psi|^2 = 1.256 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.983 +==== e( 16) = 5.23066 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 6]+0.035*[# 7] + +0.035*[# 8]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 16]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.035*[# 30]+0.035*[# 31]+0.035*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.927 + + k = 0.3333333333 0.8333333333 0.6666666667 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.961 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.015*[# 6]+0.015*[# 8]+0.015*[# 10]+0.015*[# 11] + +0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 18]+0.015*[# 19] + +0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26] + +0.015*[# 27]+0.015*[# 28]+0.015*[# 31]+0.015*[# 32]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.072 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.032*[# 6]+0.032*[# 8]+0.032*[# 14] + +0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.023*[# 10]+0.023*[# 11] + +0.023*[# 12]+0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22] + +0.023*[# 23]+0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.962 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 18]+0.027*[# 19] + +0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26] + +0.027*[# 27]+0.027*[# 28]+0.027*[# 31]+0.027*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 0.953 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.018*[# 7] + +0.018*[# 16]+0.018*[# 30]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.978 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + |psi|^2 = 0.907 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.035*[# 6]+0.035*[# 8] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14]+0.035*[# 15] + +0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23] + +0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 31] + +0.035*[# 32]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30] + |psi|^2 = 0.835 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 + + k = 0.5000000000 0.8333333333 0.6666666667 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 1.108 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18]+0.009*[# 19] + +0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24]+0.009*[# 26] + +0.009*[# 27]+0.009*[# 28]+0.008*[# 6]+0.008*[# 8]+0.008*[# 14] + +0.008*[# 15]+0.008*[# 31]+0.008*[# 32]+0.004*[# 7]+0.004*[# 16] + +0.004*[# 30] + |psi|^2 = 0.911 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.023*[# 7]+0.023*[# 16] + +0.023*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 1.025 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.025*[# 2] + +0.025*[# 3]+0.025*[# 4]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.013*[# 7] + +0.013*[# 16]+0.013*[# 30] + |psi|^2 = 0.956 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.037*[# 7]+0.037*[# 16]+0.037*[# 30] + +0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22] + +0.027*[# 23]+0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + +0.019*[# 1]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.987 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4]+0.013*[# 7] + +0.013*[# 16]+0.013*[# 30] + |psi|^2 = 0.952 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.031*[# 6]+0.031*[# 8]+0.031*[# 14]+0.031*[# 15]+0.031*[# 31] + +0.031*[# 32]+0.029*[# 1]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.964 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 7]+0.060*[# 16]+0.060*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 1.047 +==== e( 12) = 3.70168 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.046*[# 6]+0.046*[# 8] + +0.046*[# 14]+0.046*[# 15]+0.046*[# 31]+0.046*[# 32]+0.038*[# 10] + +0.038*[# 11]+0.038*[# 12]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.028*[# 1]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.010*[# 5]+0.010*[# 13]+0.010*[# 29]+0.007*[# 7] + +0.007*[# 16]+0.007*[# 30] + |psi|^2 = 1.018 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 18] + +0.044*[# 19]+0.044*[# 20]+0.044*[# 22]+0.044*[# 23]+0.044*[# 24] + +0.044*[# 26]+0.044*[# 27]+0.044*[# 28]+0.040*[# 2]+0.040*[# 3] + +0.040*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.002*[# 1] + + |psi|^2 = 1.058 +==== e( 15) = 4.84656 eV ==== + psi = 0.064*[# 2]+0.064*[# 3]+0.064*[# 4]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.879 +==== e( 16) = 4.84692 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.041*[# 7]+0.041*[# 16]+0.041*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.947 + + k = 0.6666666667 0.8333333333 0.6666666667 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.961 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 18]+0.013*[# 19]+0.013*[# 20] + +0.013*[# 22]+0.013*[# 23]+0.013*[# 24]+0.013*[# 26]+0.013*[# 27] + +0.013*[# 28]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.015*[# 6]+0.015*[# 8]+0.015*[# 10]+0.015*[# 11] + +0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 18]+0.015*[# 19] + +0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26] + +0.015*[# 27]+0.015*[# 28]+0.015*[# 31]+0.015*[# 32]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 1.072 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.032*[# 6]+0.032*[# 8]+0.032*[# 14] + +0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.023*[# 10]+0.023*[# 11] + +0.023*[# 12]+0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22] + +0.023*[# 23]+0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.962 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.033*[# 7]+0.033*[# 16]+0.033*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.033*[# 2]+0.033*[# 3] + +0.033*[# 4]+0.027*[# 6]+0.027*[# 8]+0.027*[# 10]+0.027*[# 11] + +0.027*[# 12]+0.027*[# 14]+0.027*[# 15]+0.027*[# 18]+0.027*[# 19] + +0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24]+0.027*[# 26] + +0.027*[# 27]+0.027*[# 28]+0.027*[# 31]+0.027*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 0.953 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.051*[# 6]+0.051*[# 8]+0.051*[# 14]+0.051*[# 15]+0.051*[# 31] + +0.051*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.018*[# 7] + +0.018*[# 16]+0.018*[# 30]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.978 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.021*[# 6] + +0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + |psi|^2 = 0.907 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.035*[# 6]+0.035*[# 8] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14]+0.035*[# 15] + +0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23] + +0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.035*[# 31] + +0.035*[# 32]+0.024*[# 7]+0.024*[# 16]+0.024*[# 30] + |psi|^2 = 0.835 +==== e( 15) = 4.45597 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 1.293 +==== e( 16) = 5.48297 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 + + k = 0.8333333333 0.8333333333 0.6666666667 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.730 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.025*[# 31]+0.025*[# 32]+0.025*[# 7]+0.025*[# 16] + +0.025*[# 30] + |psi|^2 = 1.271 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 10]+0.014*[# 11] + +0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 18]+0.014*[# 19] + +0.014*[# 20]+0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26] + +0.014*[# 27]+0.014*[# 28]+0.014*[# 31]+0.014*[# 32]+0.013*[# 2] + +0.013*[# 3]+0.013*[# 4] + |psi|^2 = 0.990 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.041*[# 7]+0.041*[# 16] + +0.041*[# 30]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 18] + +0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24] + +0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.133 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.742 +==== e( 8) = 2.16363 eV ==== + psi = 0.043*[# 7]+0.043*[# 16]+0.043*[# 30]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 14]+0.040*[# 15]+0.040*[# 31]+0.040*[# 32]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.899 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 7]+0.038*[# 16] + +0.038*[# 30]+0.036*[# 1]+0.036*[# 5]+0.036*[# 9]+0.036*[# 13] + +0.036*[# 17]+0.036*[# 21]+0.036*[# 25]+0.036*[# 29]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 18]+0.032*[# 19]+0.032*[# 20] + +0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26]+0.032*[# 27] + +0.032*[# 28]+0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15] + +0.025*[# 31]+0.025*[# 32] + |psi|^2 = 1.049 +==== e( 11) = 3.13966 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.037*[# 6]+0.037*[# 7] + +0.037*[# 8]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14] + +0.037*[# 15]+0.037*[# 16]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.037*[# 30]+0.037*[# 31]+0.037*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.963 +==== e( 12) = 3.51483 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.756 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.054*[# 6]+0.054*[# 8]+0.054*[# 14]+0.054*[# 15]+0.054*[# 31] + +0.054*[# 32]+0.052*[# 10]+0.052*[# 11]+0.052*[# 12]+0.052*[# 18] + +0.052*[# 19]+0.052*[# 20]+0.052*[# 22]+0.052*[# 23]+0.052*[# 24] + +0.052*[# 26]+0.052*[# 27]+0.052*[# 28]+0.050*[# 2]+0.050*[# 3] + +0.050*[# 4]+0.050*[# 7]+0.050*[# 16]+0.050*[# 30] + |psi|^2 = 1.256 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.983 +==== e( 16) = 5.23066 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 6]+0.035*[# 7] + +0.035*[# 8]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 16]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.035*[# 30]+0.035*[# 31]+0.035*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.927 + + k = 0.0000000000 0.0000000000 0.8333333333 +==== e( 1) = -5.70745 eV ==== + psi = 0.117*[# 5]+0.117*[# 9]+0.117*[# 13]+0.117*[# 17]+0.117*[# 21] + +0.117*[# 25]+0.117*[# 29]+0.117*[# 1]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.002*[# 6]+0.002*[# 7]+0.002*[# 8]+0.002*[# 10] + +0.002*[# 11]+0.002*[# 12]+0.002*[# 14]+0.002*[# 15]+0.002*[# 16] + +0.002*[# 18]+0.002*[# 19]+0.002*[# 20]+0.002*[# 22]+0.002*[# 23] + +0.002*[# 24]+0.002*[# 26]+0.002*[# 27]+0.002*[# 28]+0.002*[# 30] + +0.002*[# 31]+0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.88416 eV ==== + psi = 0.077*[# 5]+0.077*[# 9]+0.077*[# 13]+0.077*[# 17]+0.077*[# 21] + +0.077*[# 25]+0.077*[# 29]+0.076*[# 1] + |psi|^2 = 0.613 +==== e( 3) = -1.62947 eV ==== + psi = 0.147*[# 9]+0.147*[# 17]+0.147*[# 21]+0.147*[# 25]+0.050*[# 2] + +0.050*[# 3]+0.050*[# 4]+0.050*[# 6]+0.050*[# 7]+0.050*[# 8] + +0.050*[# 14]+0.050*[# 15]+0.050*[# 16]+0.050*[# 30]+0.050*[# 31] + +0.050*[# 32]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 18] + +0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23]+0.016*[# 24] + +0.016*[# 26]+0.016*[# 27]+0.016*[# 28] + |psi|^2 = 1.373 +==== e( 4) = -1.62947 eV ==== + psi = 0.147*[# 9]+0.147*[# 17]+0.147*[# 21]+0.147*[# 25]+0.034*[# 2] + +0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 16]+0.034*[# 30]+0.034*[# 31] + +0.034*[# 32] + |psi|^2 = 0.993 +==== e( 5) = -1.62936 eV ==== + psi = 0.196*[# 5]+0.196*[# 13]+0.196*[# 29]+0.034*[# 10]+0.034*[# 11] + +0.034*[# 12]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22] + +0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28] + + |psi|^2 = 0.993 +==== e( 6) = -1.62795 eV ==== + psi = 0.294*[# 1]+0.098*[# 5]+0.098*[# 13]+0.098*[# 29]+0.051*[# 10] + +0.051*[# 11]+0.051*[# 12]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28] + |psi|^2 = 1.196 +==== e( 7) = -0.30800 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 9]+0.068*[# 13]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.068*[# 29] + |psi|^2 = 0.546 +==== e( 8) = 2.97062 eV ==== + psi = 0.061*[# 10]+0.061*[# 11]+0.061*[# 12]+0.061*[# 18]+0.061*[# 19] + +0.061*[# 20]+0.061*[# 22]+0.061*[# 23]+0.061*[# 24]+0.061*[# 26] + +0.061*[# 27]+0.061*[# 28]+0.004*[# 5]+0.004*[# 13]+0.004*[# 29] + + |psi|^2 = 0.749 +==== e( 9) = 2.97089 eV ==== + psi = 0.045*[# 6]+0.045*[# 8]+0.045*[# 14]+0.045*[# 15]+0.045*[# 31] + +0.045*[# 32]+0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.044*[# 7] + +0.044*[# 16]+0.044*[# 30]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.003*[# 9] + +0.003*[# 17]+0.003*[# 21]+0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.97089 eV ==== + psi = 0.070*[# 6]+0.070*[# 8]+0.070*[# 14]+0.070*[# 15]+0.070*[# 31] + +0.070*[# 32]+0.047*[# 2]+0.047*[# 3]+0.047*[# 4]+0.048*[# 7] + +0.048*[# 16]+0.048*[# 30]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.719 +==== e( 11) = 2.97118 eV ==== + psi = 0.082*[# 10]+0.082*[# 11]+0.082*[# 12]+0.082*[# 18]+0.082*[# 19] + +0.082*[# 20]+0.082*[# 22]+0.082*[# 23]+0.082*[# 24]+0.082*[# 26] + +0.082*[# 27]+0.082*[# 28]+0.006*[# 1]+0.002*[# 5]+0.002*[# 13] + +0.002*[# 29] + |psi|^2 = 0.993 +==== e( 12) = 3.39927 eV ==== + psi = 0.083*[# 7]+0.083*[# 16]+0.083*[# 30]+0.083*[# 2]+0.083*[# 3] + +0.083*[# 4]+0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15] + +0.060*[# 31]+0.060*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + |psi|^2 = 1.355 +==== e( 13) = 3.39927 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 5.47279 eV ==== + psi = 0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 18]+0.032*[# 19] + +0.032*[# 20]+0.032*[# 22]+0.032*[# 23]+0.032*[# 24]+0.032*[# 26] + +0.032*[# 27]+0.032*[# 28]+0.022*[# 1]+0.022*[# 5]+0.022*[# 9] + +0.022*[# 13]+0.022*[# 17]+0.022*[# 21]+0.022*[# 25]+0.022*[# 29] + +0.012*[# 2]+0.012*[# 3]+0.012*[# 4]+0.012*[# 6]+0.012*[# 7] + +0.012*[# 8]+0.012*[# 14]+0.012*[# 15]+0.012*[# 16]+0.012*[# 30] + +0.012*[# 31]+0.012*[# 32] + |psi|^2 = 0.699 +==== e( 15) = 5.73469 eV ==== + psi = 0.074*[# 2]+0.074*[# 3]+0.074*[# 4]+0.074*[# 6]+0.074*[# 7] + +0.074*[# 8]+0.074*[# 10]+0.074*[# 11]+0.074*[# 12]+0.074*[# 14] + +0.074*[# 15]+0.074*[# 16]+0.074*[# 18]+0.074*[# 19]+0.074*[# 20] + +0.074*[# 22]+0.074*[# 23]+0.074*[# 24]+0.074*[# 26]+0.074*[# 27] + +0.074*[# 28]+0.074*[# 30]+0.074*[# 31]+0.074*[# 32] + |psi|^2 = 1.766 +==== e( 16) = 5.73469 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.040*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.040*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.040*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.972 + + k = 0.1666666667 0.0000000000 0.8333333333 +==== e( 1) = -5.58652 eV ==== + psi = 0.112*[# 5]+0.112*[# 9]+0.112*[# 13]+0.112*[# 17]+0.112*[# 21] + +0.112*[# 25]+0.112*[# 29]+0.111*[# 1]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.80598 eV ==== + psi = 0.103*[# 5]+0.103*[# 13]+0.103*[# 29]+0.077*[# 9]+0.077*[# 17] + +0.077*[# 21]+0.077*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15]+0.011*[# 31] + +0.011*[# 32]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.861 +==== e( 3) = -2.80522 eV ==== + psi = 0.155*[# 1]+0.077*[# 9]+0.077*[# 17]+0.077*[# 21]+0.077*[# 25] + +0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -1.80516 eV ==== + psi = 0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25]+0.079*[# 1] + +0.079*[# 5]+0.079*[# 13]+0.079*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.022*[# 6]+0.022*[# 8]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 14]+0.022*[# 15]+0.022*[# 18]+0.022*[# 19] + +0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26] + +0.022*[# 27]+0.022*[# 28]+0.022*[# 31]+0.022*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 1.159 +==== e( 5) = -1.40568 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 13]+0.070*[# 29]+0.069*[# 9] + +0.069*[# 17]+0.069*[# 21]+0.069*[# 25]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.34433 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14] + +0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.011*[# 2]+0.011*[# 3]+0.011*[# 4]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.812 +==== e( 7) = -0.34382 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20] + +0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27] + +0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32] + |psi|^2 = 0.993 +==== e( 8) = 2.26764 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14]+0.033*[# 15] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.033*[# 31] + +0.033*[# 32]+0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.796 +==== e( 9) = 3.00585 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 3.00589 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.061*[# 7]+0.061*[# 16] + +0.061*[# 30]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.007*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.993 +==== e( 11) = 3.20562 eV ==== + psi = 0.057*[# 6]+0.057*[# 8]+0.057*[# 14]+0.057*[# 15]+0.057*[# 31] + +0.057*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.948 +==== e( 12) = 3.20630 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.056*[# 7]+0.056*[# 16] + +0.056*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32] + |psi|^2 = 0.948 +==== e( 13) = 3.48375 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 4.56822 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.026*[# 1] + +0.026*[# 5]+0.026*[# 9]+0.026*[# 13]+0.026*[# 17]+0.026*[# 21] + +0.026*[# 25]+0.026*[# 29] + |psi|^2 = 1.160 +==== e( 15) = 5.28998 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.048*[# 6]+0.048*[# 7] + +0.048*[# 8]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 14] + +0.048*[# 15]+0.048*[# 16]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.048*[# 30]+0.048*[# 31]+0.048*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.166 +==== e( 16) = 6.05492 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32] + |psi|^2 = 0.800 + + k = 0.3333333333 0.0000000000 0.8333333333 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.135 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.708 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 6]+0.023*[# 7]+0.023*[# 8]+0.023*[# 10] + +0.023*[# 11]+0.023*[# 12]+0.023*[# 14]+0.023*[# 15]+0.023*[# 16] + +0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23] + +0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.023*[# 30] + +0.023*[# 31]+0.023*[# 32] + |psi|^2 = 1.221 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4]+0.007*[# 6]+0.007*[# 7]+0.007*[# 8]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 14]+0.007*[# 15]+0.007*[# 16] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.007*[# 30] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.729 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 6]+0.032*[# 7]+0.032*[# 8]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15]+0.032*[# 16] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 30] + +0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.259 +==== e( 8) = 1.85450 eV ==== + psi = 0.028*[# 2]+0.028*[# 3]+0.028*[# 4]+0.028*[# 6]+0.028*[# 7] + +0.028*[# 8]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 14] + +0.028*[# 15]+0.028*[# 16]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.028*[# 30]+0.028*[# 31]+0.028*[# 32] + |psi|^2 = 0.668 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.046*[# 6]+0.046*[# 7] + +0.046*[# 8]+0.046*[# 10]+0.046*[# 11]+0.046*[# 12]+0.046*[# 14] + +0.046*[# 15]+0.046*[# 16]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.046*[# 30]+0.046*[# 31]+0.046*[# 32] + |psi|^2 = 1.106 +==== e( 11) = 3.29155 eV ==== + psi = 0.035*[# 7]+0.035*[# 16]+0.035*[# 30]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23] + +0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.865 +==== e( 12) = 3.36033 eV ==== + psi = 0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.039*[# 6]+0.039*[# 8] + +0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 14]+0.039*[# 15] + +0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23] + +0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.039*[# 31] + +0.039*[# 32]+0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.950 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 7]+0.034*[# 6] + +0.034*[# 8]+0.035*[# 10]+0.035*[# 16]+0.035*[# 11]+0.035*[# 12] + +0.034*[# 14]+0.034*[# 15]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 30]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26] + +0.035*[# 27]+0.035*[# 28]+0.034*[# 31]+0.034*[# 32] + |psi|^2 = 0.831 +==== e( 15) = 4.50839 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.050*[# 6]+0.050*[# 7] + +0.050*[# 8]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 14] + +0.050*[# 15]+0.050*[# 16]+0.050*[# 18]+0.050*[# 19]+0.050*[# 20] + +0.050*[# 22]+0.050*[# 23]+0.050*[# 24]+0.050*[# 26]+0.050*[# 27] + +0.050*[# 28]+0.050*[# 30]+0.050*[# 31]+0.050*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.248 +==== e( 16) = 5.45761 eV ==== + psi = 0.023*[# 2]+0.023*[# 3]+0.023*[# 4]+0.023*[# 6]+0.023*[# 7] + +0.023*[# 8]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 14] + +0.023*[# 15]+0.023*[# 16]+0.023*[# 18]+0.023*[# 19]+0.023*[# 20] + +0.023*[# 22]+0.023*[# 23]+0.023*[# 24]+0.023*[# 26]+0.023*[# 27] + +0.023*[# 28]+0.023*[# 30]+0.023*[# 31]+0.023*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.578 + + k = 0.5000000000 0.0000000000 0.8333333333 +==== e( 1) = -4.63271 eV ==== + psi = 0.120*[# 5]+0.120*[# 13]+0.120*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.001*[# 6]+0.001*[# 8]+0.001*[# 14]+0.001*[# 15]+0.001*[# 31] + +0.001*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.63166 eV ==== + psi = 0.180*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 14]+0.031*[# 15]+0.031*[# 31]+0.031*[# 32]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.021*[# 2]+0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.220 +==== e( 3) = -2.29294 eV ==== + psi = 0.110*[# 5]+0.110*[# 13]+0.110*[# 29]+0.082*[# 9]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4] + +0.007*[# 10]+0.007*[# 11]+0.007*[# 12]+0.007*[# 18]+0.007*[# 19] + +0.007*[# 20]+0.007*[# 22]+0.007*[# 23]+0.007*[# 24]+0.007*[# 26] + +0.007*[# 27]+0.007*[# 28]+0.006*[# 6]+0.006*[# 8]+0.006*[# 14] + +0.006*[# 15]+0.006*[# 31]+0.006*[# 32]+0.002*[# 7]+0.002*[# 16] + +0.002*[# 30] + |psi|^2 = 0.817 +==== e( 4) = -2.29202 eV ==== + psi = 0.164*[# 1]+0.082*[# 9]+0.082*[# 17]+0.082*[# 21]+0.082*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.030*[# 7]+0.030*[# 16] + +0.030*[# 30]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 18]+0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23] + +0.016*[# 24]+0.016*[# 26]+0.016*[# 27]+0.016*[# 28] + |psi|^2 = 1.044 +==== e( 5) = -0.76680 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19] + +0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26] + +0.018*[# 27]+0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.994 +==== e( 6) = -0.76629 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.853 +==== e( 7) = 1.89706 eV ==== + psi = 0.052*[# 6]+0.052*[# 8]+0.052*[# 14]+0.052*[# 15]+0.052*[# 31] + +0.052*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.003*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.910 +==== e( 8) = 1.89734 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.031*[# 10]+0.031*[# 11] + +0.031*[# 12]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22] + +0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28] + +0.030*[# 7]+0.030*[# 16]+0.030*[# 30]+0.017*[# 6]+0.017*[# 8] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.769 +==== e( 9) = 2.23554 eV ==== + psi = 0.103*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15]+0.040*[# 31] + +0.040*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.987 +==== e( 10) = 2.23572 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.064*[# 7]+0.064*[# 16] + +0.064*[# 30]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.042*[# 2]+0.042*[# 3]+0.042*[# 4]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32] + |psi|^2 = 1.295 +==== e( 11) = 3.04468 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.040*[# 7]+0.040*[# 16] + +0.040*[# 30]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.011*[# 6]+0.011*[# 8] + +0.011*[# 14]+0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.688 +==== e( 12) = 3.04476 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.002*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.996 +==== e( 13) = 3.80535 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.989 +==== e( 14) = 3.80571 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.029*[# 10]+0.029*[# 11] + +0.029*[# 12]+0.029*[# 18]+0.029*[# 19]+0.029*[# 20]+0.029*[# 22] + +0.029*[# 23]+0.029*[# 24]+0.029*[# 26]+0.029*[# 27]+0.029*[# 28] + +0.026*[# 6]+0.026*[# 8]+0.026*[# 14]+0.026*[# 15]+0.026*[# 31] + +0.026*[# 32]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.747 +==== e( 15) = 4.52337 eV ==== + psi = 0.043*[# 7]+0.043*[# 16]+0.043*[# 30]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 18] + +0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23]+0.032*[# 24] + +0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.787 +==== e( 16) = 4.52360 eV ==== + psi = 0.030*[# 6]+0.030*[# 8]+0.030*[# 14]+0.030*[# 15]+0.030*[# 31] + +0.030*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.006*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.545 + + k = 0.6666666667 0.0000000000 0.8333333333 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 6]+0.020*[# 7]+0.020*[# 8]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 14]+0.020*[# 15]+0.020*[# 16] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.020*[# 30] + +0.020*[# 31]+0.020*[# 32] + |psi|^2 = 1.135 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.708 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 6]+0.023*[# 7]+0.023*[# 8]+0.023*[# 10] + +0.023*[# 11]+0.023*[# 12]+0.023*[# 14]+0.023*[# 15]+0.023*[# 16] + +0.023*[# 18]+0.023*[# 19]+0.023*[# 20]+0.023*[# 22]+0.023*[# 23] + +0.023*[# 24]+0.023*[# 26]+0.023*[# 27]+0.023*[# 28]+0.023*[# 30] + +0.023*[# 31]+0.023*[# 32] + |psi|^2 = 1.221 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.007*[# 2]+0.007*[# 3] + +0.007*[# 4]+0.007*[# 6]+0.007*[# 7]+0.007*[# 8]+0.007*[# 10] + +0.007*[# 11]+0.007*[# 12]+0.007*[# 14]+0.007*[# 15]+0.007*[# 16] + +0.007*[# 18]+0.007*[# 19]+0.007*[# 20]+0.007*[# 22]+0.007*[# 23] + +0.007*[# 24]+0.007*[# 26]+0.007*[# 27]+0.007*[# 28]+0.007*[# 30] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.729 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 6]+0.032*[# 7]+0.032*[# 8]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15]+0.032*[# 16] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 30] + +0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.259 +==== e( 8) = 1.85450 eV ==== + psi = 0.028*[# 2]+0.028*[# 3]+0.028*[# 4]+0.028*[# 6]+0.028*[# 7] + +0.028*[# 8]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 14] + +0.028*[# 15]+0.028*[# 16]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.028*[# 30]+0.028*[# 31]+0.028*[# 32] + |psi|^2 = 0.668 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.046*[# 6]+0.046*[# 7] + +0.046*[# 8]+0.046*[# 10]+0.046*[# 11]+0.046*[# 12]+0.046*[# 14] + +0.046*[# 15]+0.046*[# 16]+0.046*[# 18]+0.046*[# 19]+0.046*[# 20] + +0.046*[# 22]+0.046*[# 23]+0.046*[# 24]+0.046*[# 26]+0.046*[# 27] + +0.046*[# 28]+0.046*[# 30]+0.046*[# 31]+0.046*[# 32] + |psi|^2 = 1.106 +==== e( 11) = 3.29155 eV ==== + psi = 0.035*[# 7]+0.035*[# 16]+0.035*[# 30]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23] + +0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.865 +==== e( 12) = 3.36033 eV ==== + psi = 0.039*[# 2]+0.039*[# 3]+0.039*[# 4]+0.039*[# 6]+0.039*[# 8] + +0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 14]+0.039*[# 15] + +0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23] + +0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.039*[# 31] + +0.039*[# 32]+0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.950 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 7]+0.034*[# 6] + +0.034*[# 8]+0.035*[# 10]+0.035*[# 16]+0.035*[# 11]+0.035*[# 12] + +0.034*[# 14]+0.034*[# 15]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 30]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26] + +0.035*[# 27]+0.035*[# 28]+0.034*[# 31]+0.034*[# 32] + |psi|^2 = 0.831 +==== e( 15) = 4.50839 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.050*[# 6]+0.050*[# 7] + +0.050*[# 8]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 14] + +0.050*[# 15]+0.050*[# 16]+0.050*[# 18]+0.050*[# 19]+0.050*[# 20] + +0.050*[# 22]+0.050*[# 23]+0.050*[# 24]+0.050*[# 26]+0.050*[# 27] + +0.050*[# 28]+0.050*[# 30]+0.050*[# 31]+0.050*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.248 +==== e( 16) = 5.45761 eV ==== + psi = 0.023*[# 2]+0.023*[# 3]+0.023*[# 4]+0.023*[# 6]+0.023*[# 7] + +0.023*[# 8]+0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 14] + +0.023*[# 15]+0.023*[# 16]+0.023*[# 18]+0.023*[# 19]+0.023*[# 20] + +0.023*[# 22]+0.023*[# 23]+0.023*[# 24]+0.023*[# 26]+0.023*[# 27] + +0.023*[# 28]+0.023*[# 30]+0.023*[# 31]+0.023*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.578 + + k = 0.8333333333 0.0000000000 0.8333333333 +==== e( 1) = -5.58652 eV ==== + psi = 0.112*[# 5]+0.112*[# 9]+0.112*[# 13]+0.112*[# 17]+0.112*[# 21] + +0.112*[# 25]+0.112*[# 29]+0.111*[# 1]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.80598 eV ==== + psi = 0.103*[# 5]+0.103*[# 13]+0.103*[# 29]+0.077*[# 9]+0.077*[# 17] + +0.077*[# 21]+0.077*[# 25]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4] + +0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15]+0.011*[# 31] + +0.011*[# 32]+0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18] + +0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24] + +0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.861 +==== e( 3) = -2.80522 eV ==== + psi = 0.155*[# 1]+0.077*[# 9]+0.077*[# 17]+0.077*[# 21]+0.077*[# 25] + +0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -1.80516 eV ==== + psi = 0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25]+0.079*[# 1] + +0.079*[# 5]+0.079*[# 13]+0.079*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.022*[# 6]+0.022*[# 8]+0.022*[# 10]+0.022*[# 11] + +0.022*[# 12]+0.022*[# 14]+0.022*[# 15]+0.022*[# 18]+0.022*[# 19] + +0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26] + +0.022*[# 27]+0.022*[# 28]+0.022*[# 31]+0.022*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 1.159 +==== e( 5) = -1.40568 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 13]+0.070*[# 29]+0.069*[# 9] + +0.069*[# 17]+0.069*[# 21]+0.069*[# 25]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.34433 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.012*[# 6]+0.012*[# 8]+0.012*[# 14] + +0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.011*[# 2]+0.011*[# 3]+0.011*[# 4]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.812 +==== e( 7) = -0.34382 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20] + +0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27] + +0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32] + |psi|^2 = 0.993 +==== e( 8) = 2.26764 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14]+0.033*[# 15] + +0.033*[# 18]+0.033*[# 19]+0.033*[# 20]+0.033*[# 22]+0.033*[# 23] + +0.033*[# 24]+0.033*[# 26]+0.033*[# 27]+0.033*[# 28]+0.033*[# 31] + +0.033*[# 32]+0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.796 +==== e( 9) = 3.00585 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 3.00589 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.061*[# 7]+0.061*[# 16] + +0.061*[# 30]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.007*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 0.993 +==== e( 11) = 3.20562 eV ==== + psi = 0.057*[# 6]+0.057*[# 8]+0.057*[# 14]+0.057*[# 15]+0.057*[# 31] + +0.057*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.948 +==== e( 12) = 3.20630 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.056*[# 7]+0.056*[# 16] + +0.056*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32] + |psi|^2 = 0.948 +==== e( 13) = 3.48375 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 4.56822 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.026*[# 1] + +0.026*[# 5]+0.026*[# 9]+0.026*[# 13]+0.026*[# 17]+0.026*[# 21] + +0.026*[# 25]+0.026*[# 29] + |psi|^2 = 1.160 +==== e( 15) = 5.28998 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.048*[# 6]+0.048*[# 7] + +0.048*[# 8]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 14] + +0.048*[# 15]+0.048*[# 16]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.048*[# 30]+0.048*[# 31]+0.048*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.166 +==== e( 16) = 6.05492 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32] + |psi|^2 = 0.800 + + k = 0.0000000000 0.1666666667 0.8333333333 +==== e( 1) = -5.58652 eV ==== + psi = 0.112*[# 5]+0.112*[# 9]+0.112*[# 13]+0.112*[# 17]+0.112*[# 21] + +0.112*[# 25]+0.112*[# 29]+0.111*[# 1]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.80598 eV ==== + psi = 0.103*[# 5]+0.103*[# 13]+0.103*[# 29]+0.077*[# 9]+0.077*[# 17] + +0.077*[# 21]+0.077*[# 25]+0.009*[# 2]+0.009*[# 3]+0.009*[# 4] + +0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15]+0.008*[# 31] + +0.008*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.812 +==== e( 3) = -2.80522 eV ==== + psi = 0.155*[# 1]+0.077*[# 9]+0.077*[# 17]+0.077*[# 21]+0.077*[# 25] + +0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -1.80516 eV ==== + psi = 0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25]+0.079*[# 1] + +0.079*[# 5]+0.079*[# 13]+0.079*[# 29]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30]+0.015*[# 6]+0.015*[# 8]+0.015*[# 10]+0.015*[# 11] + +0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 18]+0.015*[# 19] + +0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26] + +0.015*[# 27]+0.015*[# 28]+0.015*[# 31]+0.015*[# 32]+0.014*[# 2] + +0.014*[# 3]+0.014*[# 4] + |psi|^2 = 0.987 +==== e( 5) = -1.40568 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 13]+0.070*[# 29]+0.069*[# 9] + +0.069*[# 17]+0.069*[# 21]+0.069*[# 25]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.34433 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.028*[# 6]+0.028*[# 8]+0.028*[# 14] + +0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20]+0.026*[# 22] + +0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27]+0.026*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.024*[# 7]+0.024*[# 16] + +0.024*[# 30] + |psi|^2 = 1.182 +==== e( 7) = -0.34382 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20] + +0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27] + +0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32] + |psi|^2 = 0.993 +==== e( 8) = 2.26764 eV ==== + psi = 0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 14]+0.026*[# 15] + +0.026*[# 18]+0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23] + +0.026*[# 24]+0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.026*[# 31] + +0.026*[# 32]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.626 +==== e( 9) = 3.00585 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 3.00589 eV ==== + psi = 0.098*[# 7]+0.098*[# 16]+0.098*[# 30]+0.051*[# 10]+0.051*[# 11] + +0.051*[# 12]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20]+0.051*[# 22] + +0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27]+0.051*[# 28] + +0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.007*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 1.243 +==== e( 11) = 3.20562 eV ==== + psi = 0.057*[# 6]+0.057*[# 8]+0.057*[# 14]+0.057*[# 15]+0.057*[# 31] + +0.057*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.948 +==== e( 12) = 3.20630 eV ==== + psi = 0.096*[# 2]+0.096*[# 3]+0.096*[# 4]+0.050*[# 10]+0.050*[# 11] + +0.050*[# 12]+0.050*[# 18]+0.050*[# 19]+0.050*[# 20]+0.050*[# 22] + +0.050*[# 23]+0.050*[# 24]+0.050*[# 26]+0.050*[# 27]+0.050*[# 28] + +0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.198 +==== e( 13) = 3.48375 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 4.56822 eV ==== + psi = 0.026*[# 1]+0.026*[# 5]+0.026*[# 9]+0.026*[# 13]+0.026*[# 17] + +0.026*[# 21]+0.026*[# 25]+0.026*[# 29]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.663 +==== e( 15) = 5.28999 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.048*[# 6]+0.048*[# 7] + +0.048*[# 8]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 14] + +0.048*[# 15]+0.048*[# 16]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.048*[# 30]+0.048*[# 31]+0.048*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.166 +==== e( 16) = 6.05492 eV ==== + psi = 0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.026*[# 6]+0.026*[# 7] + +0.026*[# 8]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 14] + +0.026*[# 15]+0.026*[# 16]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20] + +0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27] + +0.026*[# 28]+0.026*[# 30]+0.026*[# 31]+0.026*[# 32] + |psi|^2 = 0.628 + + k = 0.1666666667 0.1666666667 0.8333333333 +==== e( 1) = -5.46675 eV ==== + psi = 0.107*[# 5]+0.107*[# 9]+0.107*[# 13]+0.107*[# 17]+0.107*[# 21] + +0.107*[# 25]+0.107*[# 29]+0.107*[# 1]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4]+0.006*[# 6]+0.006*[# 7]+0.006*[# 8]+0.006*[# 10] + +0.006*[# 11]+0.006*[# 12]+0.006*[# 14]+0.006*[# 15]+0.006*[# 16] + +0.006*[# 18]+0.006*[# 19]+0.006*[# 20]+0.006*[# 22]+0.006*[# 23] + +0.006*[# 24]+0.006*[# 26]+0.006*[# 27]+0.006*[# 28]+0.006*[# 30] + +0.006*[# 31]+0.006*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4] + +0.012*[# 6]+0.012*[# 8]+0.012*[# 14]+0.012*[# 15]+0.012*[# 31] + +0.012*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.010*[# 7]+0.010*[# 16] + +0.010*[# 30] + |psi|^2 = 0.922 +==== e( 3) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4] + +0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15]+0.015*[# 31] + +0.015*[# 32]+0.015*[# 10]+0.015*[# 11]+0.015*[# 12]+0.015*[# 18] + +0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24] + +0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30] + |psi|^2 = 0.985 +==== e( 4) = -2.74636 eV ==== + psi = 0.237*[# 1]+0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25] + +0.026*[# 5]+0.026*[# 13]+0.026*[# 29]+0.024*[# 7]+0.024*[# 16] + +0.024*[# 30]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12]+0.017*[# 18] + +0.017*[# 19]+0.017*[# 20]+0.017*[# 22]+0.017*[# 23]+0.017*[# 24] + +0.017*[# 26]+0.017*[# 27]+0.017*[# 28]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 1.039 +==== e( 5) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.019*[# 10]+0.019*[# 11]+0.019*[# 12]+0.019*[# 18] + +0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23]+0.019*[# 24] + +0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.021*[# 2]+0.021*[# 3]+0.021*[# 4] + +0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15]+0.019*[# 31] + +0.019*[# 32]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18] + +0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24] + +0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30] + |psi|^2 = 0.976 +==== e( 7) = -0.41176 eV ==== + psi = 0.204*[# 1]+0.068*[# 9]+0.068*[# 17]+0.068*[# 21]+0.068*[# 25] + +0.023*[# 5]+0.023*[# 13]+0.023*[# 29]+0.022*[# 7]+0.022*[# 16] + +0.022*[# 30]+0.015*[# 10]+0.015*[# 11]+0.015*[# 12]+0.015*[# 18] + +0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24] + +0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.014*[# 6]+0.014*[# 8] + +0.014*[# 14]+0.014*[# 15]+0.014*[# 31]+0.014*[# 32]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4] + |psi|^2 = 0.912 +==== e( 8) = 2.48448 eV ==== + psi = 0.048*[# 6]+0.048*[# 8]+0.048*[# 14]+0.048*[# 15]+0.048*[# 31] + +0.048*[# 32]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.029*[# 7]+0.029*[# 16] + +0.029*[# 30]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.927 +==== e( 9) = 2.48448 eV ==== + psi = 0.056*[# 6]+0.056*[# 8]+0.056*[# 14]+0.056*[# 15]+0.056*[# 31] + +0.056*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.029*[# 7]+0.029*[# 16] + +0.029*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.48501 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.060*[# 2]+0.060*[# 3] + +0.060*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.015*[# 6]+0.015*[# 8] + +0.015*[# 14]+0.015*[# 15]+0.015*[# 31]+0.015*[# 32]+0.009*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.005 +==== e( 11) = 3.58915 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.985 +==== e( 12) = 3.58971 eV ==== + psi = 0.055*[# 2]+0.055*[# 3]+0.055*[# 4]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.031*[# 7]+0.031*[# 16]+0.031*[# 30]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32] + |psi|^2 = 0.876 +==== e( 13) = 3.58971 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 7]+0.062*[# 16] + +0.062*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 3.76658 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14]+0.041*[# 15] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.041*[# 31] + +0.041*[# 32]+0.028*[# 1]+0.028*[# 5]+0.028*[# 9]+0.028*[# 13] + +0.028*[# 17]+0.028*[# 21]+0.028*[# 25]+0.028*[# 29]+0.022*[# 7] + +0.022*[# 16]+0.022*[# 30] + |psi|^2 = 1.203 +==== e( 15) = 5.71627 eV ==== + psi = 0.045*[# 2]+0.045*[# 3]+0.045*[# 4]+0.045*[# 6]+0.045*[# 7] + +0.045*[# 8]+0.045*[# 10]+0.045*[# 11]+0.045*[# 12]+0.045*[# 14] + +0.045*[# 15]+0.045*[# 16]+0.045*[# 18]+0.045*[# 19]+0.045*[# 20] + +0.045*[# 22]+0.045*[# 23]+0.045*[# 24]+0.045*[# 26]+0.045*[# 27] + +0.045*[# 28]+0.045*[# 30]+0.045*[# 31]+0.045*[# 32] + |psi|^2 = 1.083 +==== e( 16) = 5.71627 eV ==== + psi = 0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.030*[# 6]+0.030*[# 7] + +0.030*[# 8]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14] + +0.030*[# 15]+0.030*[# 16]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.030*[# 30]+0.030*[# 31]+0.030*[# 32] + |psi|^2 = 0.721 + + k = 0.3333333333 0.1666666667 0.8333333333 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.118 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.136 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.026*[# 7]+0.026*[# 16] + +0.026*[# 30]+0.015*[# 10]+0.015*[# 11]+0.015*[# 12]+0.015*[# 18] + +0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24] + +0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.012*[# 6]+0.012*[# 8] + +0.012*[# 14]+0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4] + |psi|^2 = 0.853 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.020*[# 7]+0.020*[# 16] + +0.020*[# 30]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.743 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.045*[# 2]+0.045*[# 3]+0.045*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 1.070 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.985 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23] + +0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.040*[# 31] + +0.040*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.952 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.030*[# 6]+0.030*[# 7] + +0.030*[# 8]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14] + +0.030*[# 15]+0.030*[# 16]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.030*[# 30]+0.030*[# 31]+0.030*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.807 + + k = 0.5000000000 0.1666666667 0.8333333333 +==== e( 1) = -4.52498 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.52394 eV ==== + psi = 0.179*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28] + |psi|^2 = 1.202 +==== e( 3) = -2.53521 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.875 +==== e( 4) = -2.53429 eV ==== + psi = 0.172*[# 1]+0.086*[# 9]+0.086*[# 17]+0.086*[# 21]+0.086*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12]+0.017*[# 18] + +0.017*[# 19]+0.017*[# 20]+0.017*[# 22]+0.017*[# 23]+0.017*[# 24] + +0.017*[# 26]+0.017*[# 27]+0.017*[# 28]+0.016*[# 6]+0.016*[# 8] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 31]+0.016*[# 32]+0.008*[# 2] + +0.008*[# 3]+0.008*[# 4] + |psi|^2 = 1.084 +==== e( 5) = -0.69955 eV ==== + psi = 0.078*[# 5]+0.078*[# 13]+0.078*[# 29]+0.059*[# 9]+0.059*[# 17] + +0.059*[# 21]+0.059*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.69934 eV ==== + psi = 0.117*[# 1]+0.059*[# 9]+0.059*[# 17]+0.059*[# 21]+0.059*[# 25] + +0.039*[# 5]+0.039*[# 13]+0.039*[# 29]+0.029*[# 7]+0.029*[# 16] + +0.029*[# 30]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 18] + +0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23]+0.016*[# 24] + +0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.013*[# 6]+0.013*[# 8] + +0.013*[# 14]+0.013*[# 15]+0.013*[# 31]+0.013*[# 32]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4] + |psi|^2 = 0.856 +==== e( 7) = 1.70960 eV ==== + psi = 0.051*[# 5]+0.051*[# 13]+0.051*[# 29]+0.048*[# 7]+0.048*[# 16] + +0.048*[# 30]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.029*[# 1]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.020*[# 2] + +0.020*[# 3]+0.020*[# 4] + |psi|^2 = 1.035 +==== e( 8) = 1.71009 eV ==== + psi = 0.062*[# 1]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.027*[# 2] + +0.027*[# 3]+0.027*[# 4]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12] + +0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23] + +0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.899 +==== e( 9) = 2.10371 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.10436 eV ==== + psi = 0.050*[# 7]+0.050*[# 16]+0.050*[# 30]+0.045*[# 2]+0.045*[# 3] + +0.045*[# 4]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.017*[# 1] + +0.009*[# 9]+0.009*[# 17]+0.009*[# 21]+0.009*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 0.938 +==== e( 11) = 3.36740 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30] + |psi|^2 = 1.043 +==== e( 12) = 3.36742 eV ==== + psi = 0.067*[# 2]+0.067*[# 3]+0.067*[# 4]+0.051*[# 7]+0.051*[# 16] + +0.051*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.001*[# 1] + + |psi|^2 = 0.988 +==== e( 13) = 4.14946 eV ==== + psi = 0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.028*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.988 +==== e( 14) = 4.14988 eV ==== + psi = 0.056*[# 7]+0.056*[# 16]+0.056*[# 30]+0.052*[# 2]+0.052*[# 3] + +0.052*[# 4]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.002*[# 1] + |psi|^2 = 1.156 +==== e( 15) = 4.40345 eV ==== + psi = 0.042*[# 7]+0.042*[# 16]+0.042*[# 30]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.030*[# 31] + +0.030*[# 32]+0.019*[# 2]+0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.728 +==== e( 16) = 4.40456 eV ==== + psi = 0.069*[# 2]+0.069*[# 3]+0.069*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.896 + + k = 0.6666666667 0.1666666667 0.8333333333 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.118 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.136 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.026*[# 7]+0.026*[# 16] + +0.026*[# 30]+0.015*[# 10]+0.015*[# 11]+0.015*[# 12]+0.015*[# 18] + +0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24] + +0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.012*[# 6]+0.012*[# 8] + +0.012*[# 14]+0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4] + |psi|^2 = 0.853 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.020*[# 7]+0.020*[# 16] + +0.020*[# 30]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.743 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.045*[# 2]+0.045*[# 3]+0.045*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 1.070 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.985 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23] + +0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.040*[# 31] + +0.040*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.952 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.030*[# 6]+0.030*[# 7] + +0.030*[# 8]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14] + +0.030*[# 15]+0.030*[# 16]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.030*[# 30]+0.030*[# 31]+0.030*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.807 + + k = 0.8333333333 0.1666666667 0.8333333333 +==== e( 1) = -5.46675 eV ==== + psi = 0.107*[# 5]+0.107*[# 9]+0.107*[# 13]+0.107*[# 17]+0.107*[# 21] + +0.107*[# 25]+0.107*[# 29]+0.107*[# 1]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4]+0.006*[# 6]+0.006*[# 7]+0.006*[# 8]+0.006*[# 10] + +0.006*[# 11]+0.006*[# 12]+0.006*[# 14]+0.006*[# 15]+0.006*[# 16] + +0.006*[# 18]+0.006*[# 19]+0.006*[# 20]+0.006*[# 22]+0.006*[# 23] + +0.006*[# 24]+0.006*[# 26]+0.006*[# 27]+0.006*[# 28]+0.006*[# 30] + +0.006*[# 31]+0.006*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.012*[# 2]+0.012*[# 3]+0.012*[# 4] + +0.011*[# 6]+0.011*[# 8]+0.011*[# 14]+0.011*[# 15]+0.011*[# 31] + +0.011*[# 32]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12]+0.011*[# 18] + +0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24] + +0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30] + |psi|^2 = 0.888 +==== e( 3) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + +0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15]+0.018*[# 31] + +0.018*[# 32]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18] + +0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24] + +0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.014*[# 7]+0.014*[# 16] + +0.014*[# 30] + |psi|^2 = 1.054 +==== e( 4) = -2.74636 eV ==== + psi = 0.237*[# 1]+0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25] + +0.026*[# 5]+0.026*[# 13]+0.026*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18] + +0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24] + +0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.017*[# 6]+0.017*[# 8] + +0.017*[# 14]+0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.016*[# 2] + +0.016*[# 3]+0.016*[# 4] + |psi|^2 = 1.054 +==== e( 5) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.019*[# 10]+0.019*[# 11]+0.019*[# 12]+0.019*[# 18] + +0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23]+0.019*[# 24] + +0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18] + +0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24] + +0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30] + |psi|^2 = 0.973 +==== e( 7) = -0.41176 eV ==== + psi = 0.204*[# 1]+0.068*[# 9]+0.068*[# 17]+0.068*[# 21]+0.068*[# 25] + +0.029*[# 7]+0.029*[# 16]+0.029*[# 30]+0.023*[# 5]+0.023*[# 13] + +0.023*[# 29]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.072 +==== e( 8) = 2.48448 eV ==== + psi = 0.046*[# 6]+0.046*[# 8]+0.046*[# 14]+0.046*[# 15]+0.046*[# 31] + +0.046*[# 32]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 18] + +0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23]+0.032*[# 24] + +0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.022*[# 7]+0.022*[# 16] + +0.022*[# 30]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.790 +==== e( 9) = 2.48448 eV ==== + psi = 0.056*[# 6]+0.056*[# 8]+0.056*[# 14]+0.056*[# 15]+0.056*[# 31] + +0.056*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.029*[# 7]+0.029*[# 16] + +0.029*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.48501 eV ==== + psi = 0.068*[# 7]+0.068*[# 16]+0.068*[# 30]+0.058*[# 2]+0.058*[# 3] + +0.058*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.020*[# 6]+0.020*[# 8] + +0.020*[# 14]+0.020*[# 15]+0.020*[# 31]+0.020*[# 32]+0.009*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.019 +==== e( 11) = 3.58915 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.985 +==== e( 12) = 3.58971 eV ==== + psi = 0.056*[# 2]+0.056*[# 3]+0.056*[# 4]+0.037*[# 10]+0.037*[# 11] + +0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22] + +0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28] + +0.031*[# 7]+0.031*[# 16]+0.031*[# 30]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32] + |psi|^2 = 0.882 +==== e( 13) = 3.58971 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 7]+0.062*[# 16] + +0.062*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 3.76658 eV ==== + psi = 0.058*[# 2]+0.058*[# 3]+0.058*[# 4]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23] + +0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.040*[# 31] + +0.040*[# 32]+0.028*[# 1]+0.028*[# 5]+0.028*[# 9]+0.028*[# 13] + +0.028*[# 17]+0.028*[# 21]+0.028*[# 25]+0.028*[# 29]+0.022*[# 7] + +0.022*[# 16]+0.022*[# 30] + |psi|^2 = 1.189 +==== e( 15) = 5.71627 eV ==== + psi = 0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.044*[# 6]+0.044*[# 7] + +0.044*[# 8]+0.044*[# 10]+0.044*[# 11]+0.044*[# 12]+0.044*[# 14] + +0.044*[# 15]+0.044*[# 16]+0.044*[# 18]+0.044*[# 19]+0.044*[# 20] + +0.044*[# 22]+0.044*[# 23]+0.044*[# 24]+0.044*[# 26]+0.044*[# 27] + +0.044*[# 28]+0.044*[# 30]+0.044*[# 31]+0.044*[# 32] + |psi|^2 = 1.057 +==== e( 16) = 5.71627 eV ==== + psi = 0.031*[# 2]+0.031*[# 3]+0.031*[# 4]+0.031*[# 6]+0.031*[# 7] + +0.031*[# 8]+0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14] + +0.031*[# 15]+0.031*[# 16]+0.031*[# 18]+0.031*[# 19]+0.031*[# 20] + +0.031*[# 22]+0.031*[# 23]+0.031*[# 24]+0.031*[# 26]+0.031*[# 27] + +0.031*[# 28]+0.031*[# 30]+0.031*[# 31]+0.031*[# 32] + |psi|^2 = 0.746 + + k = 0.0000000000 0.3333333333 0.8333333333 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.983 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.708 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.911 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.021*[# 6]+0.021*[# 7]+0.021*[# 8]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 14]+0.021*[# 15]+0.021*[# 16] + +0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23] + +0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.021*[# 30] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.053 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 6]+0.032*[# 7]+0.032*[# 8]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15]+0.032*[# 16] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 30] + +0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.259 +==== e( 8) = 1.85450 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32] + |psi|^2 = 0.789 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.050*[# 6]+0.050*[# 14]+0.050*[# 32]+0.050*[# 2]+0.050*[# 3] + +0.050*[# 4]+0.050*[# 7]+0.050*[# 15]+0.050*[# 8]+0.050*[# 10] + +0.050*[# 11]+0.050*[# 12]+0.050*[# 28]+0.050*[# 31]+0.050*[# 16] + +0.050*[# 18]+0.050*[# 19]+0.050*[# 20]+0.050*[# 22]+0.050*[# 23] + +0.050*[# 24]+0.050*[# 26]+0.050*[# 27]+0.050*[# 30] + |psi|^2 = 1.198 +==== e( 11) = 3.29155 eV ==== + psi = 0.035*[# 7]+0.035*[# 16]+0.035*[# 30]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23] + +0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.865 +==== e( 12) = 3.36033 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 6]+0.035*[# 7] + +0.035*[# 8]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 16]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.035*[# 30]+0.035*[# 31]+0.035*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.846 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.026*[# 6]+0.026*[# 7] + +0.026*[# 8]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 14] + +0.026*[# 15]+0.026*[# 16]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20] + +0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27] + +0.026*[# 28]+0.026*[# 30]+0.026*[# 31]+0.026*[# 32] + |psi|^2 = 0.634 +==== e( 15) = 4.50839 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.050*[# 6]+0.050*[# 7] + +0.050*[# 8]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 14] + +0.050*[# 15]+0.050*[# 16]+0.050*[# 18]+0.050*[# 19]+0.050*[# 20] + +0.050*[# 22]+0.050*[# 23]+0.050*[# 24]+0.050*[# 26]+0.050*[# 27] + +0.050*[# 28]+0.050*[# 30]+0.050*[# 31]+0.050*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.248 +==== e( 16) = 5.45761 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.818 + + k = 0.1666666667 0.3333333333 0.8333333333 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 1.011 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30]+0.008*[# 2]+0.008*[# 3]+0.008*[# 4]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20] + +0.008*[# 22]+0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27] + +0.008*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.855 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.048*[# 6]+0.048*[# 8]+0.048*[# 14]+0.048*[# 15]+0.048*[# 31] + +0.048*[# 32]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.034*[# 7]+0.034*[# 16] + +0.034*[# 30]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.883 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30] + |psi|^2 = 1.086 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.022*[# 2]+0.022*[# 3] + +0.022*[# 4]+0.018*[# 7]+0.018*[# 16]+0.018*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.948 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.034*[# 7]+0.034*[# 16]+0.034*[# 30]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 31] + +0.032*[# 32]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + |psi|^2 = 0.760 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.303 + + k = 0.3333333333 0.3333333333 0.8333333333 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4] + +0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30] + |psi|^2 = 1.070 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.004*[# 2] + +0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20] + +0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27] + +0.011*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.975 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.035*[# 2]+0.035*[# 3]+0.035*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.021*[# 31]+0.021*[# 32]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.925 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.029*[# 7] + +0.029*[# 16]+0.029*[# 30]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.922 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.026*[# 7]+0.026*[# 16]+0.026*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.868 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 6]+0.052*[# 8]+0.052*[# 14]+0.052*[# 15]+0.052*[# 31] + +0.052*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.036*[# 6]+0.036*[# 8]+0.036*[# 14]+0.036*[# 15]+0.036*[# 31] + +0.036*[# 32]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + |psi|^2 = 0.937 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.066*[# 7]+0.066*[# 16]+0.066*[# 30]+0.066*[# 2]+0.066*[# 3] + +0.066*[# 4]+0.055*[# 10]+0.055*[# 11]+0.055*[# 12]+0.055*[# 18] + +0.055*[# 19]+0.055*[# 20]+0.055*[# 22]+0.055*[# 23]+0.055*[# 24] + +0.055*[# 26]+0.055*[# 27]+0.055*[# 28]+0.044*[# 6]+0.044*[# 8] + +0.044*[# 14]+0.044*[# 15]+0.044*[# 31]+0.044*[# 32] + |psi|^2 = 1.330 +==== e( 15) = 4.45597 eV ==== + psi = 0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.016*[# 6]+0.016*[# 7] + +0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 14] + +0.016*[# 15]+0.016*[# 16]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 30]+0.016*[# 31]+0.016*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.450 +==== e( 16) = 5.48297 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 6]+0.062*[# 7] + +0.062*[# 8]+0.062*[# 10]+0.062*[# 11]+0.062*[# 12]+0.062*[# 14] + +0.062*[# 15]+0.062*[# 16]+0.062*[# 18]+0.062*[# 19]+0.062*[# 20] + +0.062*[# 22]+0.062*[# 23]+0.062*[# 24]+0.062*[# 26]+0.062*[# 27] + +0.062*[# 28]+0.062*[# 30]+0.062*[# 31]+0.062*[# 32] + |psi|^2 = 1.479 + + k = 0.5000000000 0.3333333333 0.8333333333 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28] + |psi|^2 = 1.152 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4] + |psi|^2 = 0.948 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12] + +0.017*[# 18]+0.017*[# 19]+0.017*[# 20]+0.017*[# 22]+0.017*[# 23] + +0.017*[# 24]+0.017*[# 26]+0.017*[# 27]+0.017*[# 28]+0.013*[# 2] + +0.013*[# 3]+0.013*[# 4] + |psi|^2 = 1.106 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.024*[# 6]+0.024*[# 8]+0.024*[# 14]+0.024*[# 15] + +0.024*[# 31]+0.024*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.004*[# 7] + +0.004*[# 16]+0.004*[# 30] + |psi|^2 = 0.860 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.042*[# 7]+0.042*[# 16]+0.042*[# 30] + +0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.019*[# 1] + |psi|^2 = 1.020 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.022*[# 10] + +0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20] + +0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27] + +0.022*[# 28]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 0.888 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.030*[# 7]+0.030*[# 16] + +0.030*[# 30]+0.029*[# 1]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.023*[# 6] + +0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.760 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31] + +0.027*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.954 +==== e( 12) = 3.70168 eV ==== + psi = 0.034*[# 6]+0.034*[# 8]+0.034*[# 14]+0.034*[# 15]+0.034*[# 31] + +0.034*[# 32]+0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12] + +0.025*[# 18]+0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23] + +0.025*[# 24]+0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.722 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.073*[# 2]+0.073*[# 3]+0.073*[# 4]+0.071*[# 6]+0.071*[# 8] + +0.071*[# 14]+0.071*[# 15]+0.071*[# 31]+0.071*[# 32]+0.057*[# 10] + +0.057*[# 11]+0.057*[# 12]+0.057*[# 18]+0.057*[# 19]+0.057*[# 20] + +0.057*[# 22]+0.057*[# 23]+0.057*[# 24]+0.057*[# 26]+0.057*[# 27] + +0.057*[# 28]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.002*[# 1] + + |psi|^2 = 1.371 +==== e( 15) = 4.84656 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.977 +==== e( 16) = 4.84692 eV ==== + psi = 0.068*[# 6]+0.068*[# 8]+0.068*[# 14]+0.068*[# 15]+0.068*[# 31] + +0.068*[# 32]+0.056*[# 10]+0.056*[# 11]+0.056*[# 12]+0.056*[# 18] + +0.056*[# 19]+0.056*[# 20]+0.056*[# 22]+0.056*[# 23]+0.056*[# 24] + +0.056*[# 26]+0.056*[# 27]+0.056*[# 28]+0.049*[# 2]+0.049*[# 3] + +0.049*[# 4]+0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.358 + + k = 0.6666666667 0.3333333333 0.8333333333 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4] + +0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30] + |psi|^2 = 1.070 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.004*[# 2] + +0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20] + +0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27] + +0.011*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.975 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.035*[# 2]+0.035*[# 3]+0.035*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.021*[# 31]+0.021*[# 32]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.925 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.029*[# 7] + +0.029*[# 16]+0.029*[# 30]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.922 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.026*[# 7]+0.026*[# 16]+0.026*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.868 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 6]+0.052*[# 8]+0.052*[# 14]+0.052*[# 15]+0.052*[# 31] + +0.052*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.036*[# 6]+0.036*[# 8]+0.036*[# 14]+0.036*[# 15]+0.036*[# 31] + +0.036*[# 32]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + |psi|^2 = 0.937 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.066*[# 7]+0.066*[# 16]+0.066*[# 30]+0.066*[# 2]+0.066*[# 3] + +0.066*[# 4]+0.055*[# 10]+0.055*[# 11]+0.055*[# 12]+0.055*[# 18] + +0.055*[# 19]+0.055*[# 20]+0.055*[# 22]+0.055*[# 23]+0.055*[# 24] + +0.055*[# 26]+0.055*[# 27]+0.055*[# 28]+0.044*[# 6]+0.044*[# 8] + +0.044*[# 14]+0.044*[# 15]+0.044*[# 31]+0.044*[# 32] + |psi|^2 = 1.330 +==== e( 15) = 4.45597 eV ==== + psi = 0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.016*[# 6]+0.016*[# 7] + +0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 14] + +0.016*[# 15]+0.016*[# 16]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 30]+0.016*[# 31]+0.016*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.450 +==== e( 16) = 5.48297 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 6]+0.062*[# 7] + +0.062*[# 8]+0.062*[# 10]+0.062*[# 11]+0.062*[# 12]+0.062*[# 14] + +0.062*[# 15]+0.062*[# 16]+0.062*[# 18]+0.062*[# 19]+0.062*[# 20] + +0.062*[# 22]+0.062*[# 23]+0.062*[# 24]+0.062*[# 26]+0.062*[# 27] + +0.062*[# 28]+0.062*[# 30]+0.062*[# 31]+0.062*[# 32] + |psi|^2 = 1.479 + + k = 0.8333333333 0.3333333333 0.8333333333 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 1.011 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30]+0.008*[# 2]+0.008*[# 3]+0.008*[# 4]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20] + +0.008*[# 22]+0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27] + +0.008*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.855 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.048*[# 6]+0.048*[# 8]+0.048*[# 14]+0.048*[# 15]+0.048*[# 31] + +0.048*[# 32]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.034*[# 7]+0.034*[# 16] + +0.034*[# 30]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.883 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30] + |psi|^2 = 1.086 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.022*[# 2]+0.022*[# 3] + +0.022*[# 4]+0.018*[# 7]+0.018*[# 16]+0.018*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.948 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.034*[# 7]+0.034*[# 16]+0.034*[# 30]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 31] + +0.032*[# 32]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + |psi|^2 = 0.760 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.303 + + k = 0.0000000000 0.5000000000 0.8333333333 +==== e( 1) = -4.63271 eV ==== + psi = 0.120*[# 5]+0.120*[# 13]+0.120*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30] + +0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.011*[# 10]+0.011*[# 11] + +0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20]+0.011*[# 22] + +0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27]+0.011*[# 28] + +0.001*[# 6]+0.001*[# 8]+0.001*[# 14]+0.001*[# 15]+0.001*[# 31] + +0.001*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.63166 eV ==== + psi = 0.180*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20] + +0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27] + +0.011*[# 28] + |psi|^2 = 0.974 +==== e( 3) = -2.29294 eV ==== + psi = 0.110*[# 5]+0.110*[# 13]+0.110*[# 29]+0.082*[# 9]+0.082*[# 17] + +0.082*[# 21]+0.082*[# 25]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4] + +0.007*[# 10]+0.007*[# 11]+0.007*[# 12]+0.007*[# 18]+0.007*[# 19] + +0.007*[# 20]+0.007*[# 22]+0.007*[# 23]+0.007*[# 24]+0.007*[# 26] + +0.007*[# 27]+0.007*[# 28]+0.006*[# 6]+0.006*[# 8]+0.006*[# 14] + +0.006*[# 15]+0.006*[# 31]+0.006*[# 32]+0.002*[# 7]+0.002*[# 16] + +0.002*[# 30] + |psi|^2 = 0.817 +==== e( 4) = -2.29202 eV ==== + psi = 0.164*[# 1]+0.082*[# 9]+0.082*[# 17]+0.082*[# 21]+0.082*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.010*[# 7]+0.010*[# 16] + +0.010*[# 30]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32]+0.006*[# 10]+0.006*[# 11]+0.006*[# 12] + +0.006*[# 18]+0.006*[# 19]+0.006*[# 20]+0.006*[# 22]+0.006*[# 23] + +0.006*[# 24]+0.006*[# 26]+0.006*[# 27]+0.006*[# 28] + |psi|^2 = 0.799 +==== e( 5) = -0.76680 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4] + +0.018*[# 10]+0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19] + +0.018*[# 20]+0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26] + +0.018*[# 27]+0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14] + +0.017*[# 15]+0.017*[# 31]+0.017*[# 32]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30] + |psi|^2 = 0.994 +==== e( 6) = -0.76629 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.022*[# 10] + +0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20] + +0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27] + +0.022*[# 28]+0.021*[# 2]+0.021*[# 3]+0.021*[# 4]+0.021*[# 7] + +0.021*[# 16]+0.021*[# 30] + |psi|^2 = 1.088 +==== e( 7) = 1.89706 eV ==== + psi = 0.052*[# 6]+0.052*[# 8]+0.052*[# 14]+0.052*[# 15]+0.052*[# 31] + +0.052*[# 32]+0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 18] + +0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23]+0.037*[# 24] + +0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.033*[# 7]+0.033*[# 16] + +0.033*[# 30]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4]+0.003*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.910 +==== e( 8) = 1.89734 eV ==== + psi = 0.061*[# 2]+0.061*[# 3]+0.061*[# 4]+0.050*[# 7]+0.050*[# 16] + +0.050*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 1.004 +==== e( 9) = 2.23554 eV ==== + psi = 0.103*[# 1]+0.051*[# 9]+0.051*[# 17]+0.051*[# 21]+0.051*[# 25] + +0.040*[# 6]+0.040*[# 8]+0.040*[# 14]+0.040*[# 15]+0.040*[# 31] + +0.040*[# 32]+0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.010*[# 7]+0.010*[# 16]+0.010*[# 30]+0.006*[# 2] + +0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.987 +==== e( 10) = 2.23572 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.051*[# 9]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.042*[# 2]+0.042*[# 3]+0.042*[# 4] + +0.041*[# 7]+0.041*[# 16]+0.041*[# 30]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20]+0.026*[# 22] + +0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27]+0.026*[# 28] + +0.009*[# 6]+0.009*[# 8]+0.009*[# 14]+0.009*[# 15]+0.009*[# 31] + +0.009*[# 32] + |psi|^2 = 1.024 +==== e( 11) = 3.04468 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.040*[# 7]+0.040*[# 16] + +0.040*[# 30]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.011*[# 6]+0.011*[# 8] + +0.011*[# 14]+0.011*[# 15]+0.011*[# 31]+0.011*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29]+0.001*[# 9]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25] + |psi|^2 = 0.688 +==== e( 12) = 3.04476 eV ==== + psi = 0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 18] + +0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23]+0.030*[# 24] + +0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.016*[# 7]+0.016*[# 16] + +0.016*[# 30]+0.010*[# 2]+0.010*[# 3]+0.010*[# 4]+0.002*[# 1] + +0.001*[# 9]+0.001*[# 17]+0.001*[# 21]+0.001*[# 25] + |psi|^2 = 0.725 +==== e( 13) = 3.80535 eV ==== + psi = 0.046*[# 7]+0.046*[# 16]+0.046*[# 30]+0.042*[# 6]+0.042*[# 8] + +0.042*[# 14]+0.042*[# 15]+0.042*[# 31]+0.042*[# 32]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.027*[# 2]+0.027*[# 3]+0.027*[# 4]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.989 +==== e( 14) = 3.80571 eV ==== + psi = 0.052*[# 2]+0.052*[# 3]+0.052*[# 4]+0.052*[# 7]+0.052*[# 16] + +0.052*[# 30]+0.049*[# 10]+0.049*[# 11]+0.049*[# 12]+0.049*[# 18] + +0.049*[# 19]+0.049*[# 20]+0.049*[# 22]+0.049*[# 23]+0.049*[# 24] + +0.049*[# 26]+0.049*[# 27]+0.049*[# 28]+0.045*[# 6]+0.045*[# 8] + +0.045*[# 14]+0.045*[# 15]+0.045*[# 31]+0.045*[# 32]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 1.216 +==== e( 15) = 4.52337 eV ==== + psi = 0.043*[# 7]+0.043*[# 16]+0.043*[# 30]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 18] + +0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23]+0.032*[# 24] + +0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.024*[# 6]+0.024*[# 8] + +0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.787 +==== e( 16) = 4.52360 eV ==== + psi = 0.049*[# 6]+0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 31] + +0.049*[# 32]+0.046*[# 2]+0.046*[# 3]+0.046*[# 4]+0.041*[# 10] + +0.041*[# 11]+0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30]+0.006*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 1.014 + + k = 0.1666666667 0.5000000000 0.8333333333 +==== e( 1) = -4.52498 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.52394 eV ==== + psi = 0.179*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.002*[# 2]+0.002*[# 3]+0.002*[# 4]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.993 +==== e( 3) = -2.53521 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.875 +==== e( 4) = -2.53429 eV ==== + psi = 0.172*[# 1]+0.086*[# 9]+0.086*[# 17]+0.086*[# 21]+0.086*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.008*[# 7]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12] + +0.008*[# 16]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.008*[# 30]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.875 +==== e( 5) = -0.69955 eV ==== + psi = 0.078*[# 5]+0.078*[# 13]+0.078*[# 29]+0.059*[# 9]+0.059*[# 17] + +0.059*[# 21]+0.059*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.69934 eV ==== + psi = 0.117*[# 1]+0.059*[# 9]+0.059*[# 17]+0.059*[# 21]+0.059*[# 25] + +0.039*[# 5]+0.039*[# 13]+0.039*[# 29]+0.025*[# 2]+0.025*[# 3] + +0.025*[# 4]+0.025*[# 7]+0.025*[# 16]+0.025*[# 30]+0.022*[# 10] + +0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20] + +0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27] + +0.022*[# 28]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 7) = 1.70960 eV ==== + psi = 0.051*[# 5]+0.051*[# 13]+0.051*[# 29]+0.048*[# 7]+0.048*[# 16] + +0.048*[# 30]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.029*[# 1]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.020*[# 2] + +0.020*[# 3]+0.020*[# 4] + |psi|^2 = 1.035 +==== e( 8) = 1.71009 eV ==== + psi = 0.062*[# 1]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.028*[# 10] + +0.028*[# 11]+0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4]+0.021*[# 7] + +0.021*[# 16]+0.021*[# 30] + |psi|^2 = 1.035 +==== e( 9) = 2.10371 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.10436 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.050*[# 7]+0.050*[# 16] + +0.050*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.017*[# 1] + +0.009*[# 9]+0.009*[# 17]+0.009*[# 21]+0.009*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 0.993 +==== e( 11) = 3.36740 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30] + |psi|^2 = 1.043 +==== e( 12) = 3.36742 eV ==== + psi = 0.067*[# 2]+0.067*[# 3]+0.067*[# 4]+0.056*[# 7]+0.056*[# 16] + +0.056*[# 30]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.001*[# 1] + + |psi|^2 = 1.043 +==== e( 13) = 4.14946 eV ==== + psi = 0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.028*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.988 +==== e( 14) = 4.14988 eV ==== + psi = 0.047*[# 2]+0.047*[# 3]+0.047*[# 4]+0.047*[# 7]+0.047*[# 16] + +0.047*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.002*[# 1] + |psi|^2 = 0.988 +==== e( 15) = 4.40345 eV ==== + psi = 0.042*[# 7]+0.042*[# 16]+0.042*[# 30]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.030*[# 31] + +0.030*[# 32]+0.019*[# 2]+0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.728 +==== e( 16) = 4.40456 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.030*[# 31] + +0.030*[# 32] + |psi|^2 = 0.728 + + k = 0.3333333333 0.5000000000 0.8333333333 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 1.038 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4] + |psi|^2 = 0.948 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12] + +0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23] + +0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.004*[# 7] + +0.004*[# 16]+0.004*[# 30] + |psi|^2 = 0.992 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.017*[# 7] + +0.017*[# 16]+0.017*[# 30] + |psi|^2 = 0.895 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.042*[# 7]+0.042*[# 16]+0.042*[# 30] + +0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.019*[# 1] + |psi|^2 = 1.020 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.031*[# 2] + +0.031*[# 3]+0.031*[# 4]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.001*[# 7] + +0.001*[# 16]+0.001*[# 30] + |psi|^2 = 0.923 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.032*[# 7]+0.032*[# 16] + +0.032*[# 30]+0.029*[# 1]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12] + +0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23] + +0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.024*[# 6] + +0.024*[# 8]+0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.789 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31] + +0.027*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.954 +==== e( 12) = 3.70168 eV ==== + psi = 0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.028*[# 1]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.023*[# 2] + +0.023*[# 3]+0.023*[# 4]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.750 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.068*[# 6]+0.068*[# 8]+0.068*[# 14]+0.068*[# 15]+0.068*[# 31] + +0.068*[# 32]+0.054*[# 10]+0.054*[# 11]+0.054*[# 12]+0.054*[# 18] + +0.054*[# 19]+0.054*[# 20]+0.054*[# 22]+0.054*[# 23]+0.054*[# 24] + +0.054*[# 26]+0.054*[# 27]+0.054*[# 28]+0.040*[# 2]+0.040*[# 3] + +0.040*[# 4]+0.040*[# 7]+0.040*[# 16]+0.040*[# 30]+0.002*[# 1] + + |psi|^2 = 1.302 +==== e( 15) = 4.84656 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.977 +==== e( 16) = 4.84692 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.065*[# 6]+0.065*[# 8] + +0.065*[# 14]+0.065*[# 15]+0.065*[# 31]+0.065*[# 32]+0.053*[# 10] + +0.053*[# 11]+0.053*[# 12]+0.053*[# 18]+0.053*[# 19]+0.053*[# 20] + +0.053*[# 22]+0.053*[# 23]+0.053*[# 24]+0.053*[# 26]+0.053*[# 27] + +0.053*[# 28]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.290 + + k = 0.5000000000 0.5000000000 0.8333333333 +==== e( 1) = -3.71242 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19] + +0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26] + +0.012*[# 27]+0.012*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -3.71222 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 2]+0.021*[# 3]+0.021*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.015*[# 10]+0.015*[# 11]+0.015*[# 12]+0.015*[# 18] + +0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24] + +0.015*[# 26]+0.015*[# 27]+0.015*[# 28] + |psi|^2 = 1.077 +==== e( 3) = -3.71222 eV ==== + psi = 0.118*[# 5]+0.118*[# 13]+0.118*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 2]+0.021*[# 3]+0.021*[# 4] + +0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15]+0.014*[# 31] + +0.014*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12]+0.012*[# 18] + +0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23]+0.012*[# 24] + +0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + |psi|^2 = 0.994 +==== e( 4) = -3.71037 eV ==== + psi = 0.353*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.019*[# 6]+0.019*[# 8] + +0.019*[# 14]+0.019*[# 15]+0.019*[# 31]+0.019*[# 32]+0.015*[# 10] + +0.015*[# 11]+0.015*[# 12]+0.015*[# 18]+0.015*[# 19]+0.015*[# 20] + +0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26]+0.015*[# 27] + +0.015*[# 28]+0.004*[# 7]+0.004*[# 16]+0.004*[# 30] + |psi|^2 = 1.077 +==== e( 5) = 0.12722 eV ==== + psi = 0.098*[# 7]+0.098*[# 16]+0.098*[# 30]+0.045*[# 5]+0.045*[# 13] + +0.045*[# 29]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.041*[# 1]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4] + |psi|^2 = 0.991 +==== e( 6) = 0.12772 eV ==== + psi = 0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.029*[# 2]+0.029*[# 3]+0.029*[# 4] + +0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28] + |psi|^2 = 0.883 +==== e( 7) = 0.12772 eV ==== + psi = 0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.038*[# 6]+0.038*[# 8]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 31]+0.038*[# 32]+0.029*[# 2]+0.029*[# 3] + +0.029*[# 4]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12]+0.027*[# 18] + +0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23]+0.027*[# 24] + +0.027*[# 26]+0.027*[# 27]+0.027*[# 28] + |psi|^2 = 0.991 +==== e( 8) = 0.12828 eV ==== + psi = 0.135*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.029*[# 6]+0.029*[# 8]+0.029*[# 14]+0.029*[# 15]+0.029*[# 31] + +0.029*[# 32]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4]+0.022*[# 10] + +0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20] + +0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27] + +0.022*[# 28]+0.014*[# 5]+0.014*[# 13]+0.014*[# 29]+0.005*[# 7] + +0.005*[# 16]+0.005*[# 30] + |psi|^2 = 0.883 +==== e( 9) = 3.08095 eV ==== + psi = 0.122*[# 7]+0.122*[# 16]+0.122*[# 30]+0.036*[# 10]+0.036*[# 11] + +0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20]+0.036*[# 22] + +0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27]+0.036*[# 28] + +0.020*[# 5]+0.020*[# 13]+0.020*[# 29]+0.016*[# 9]+0.016*[# 17] + +0.016*[# 21]+0.016*[# 25]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14] + +0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.002*[# 2]+0.002*[# 3] + +0.002*[# 4]+0.001*[# 1] + |psi|^2 = 0.991 +==== e( 10) = 3.08168 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.021*[# 5]+0.021*[# 13]+0.021*[# 29]+0.016*[# 9] + +0.016*[# 17]+0.016*[# 21]+0.016*[# 25] + |psi|^2 = 0.703 +==== e( 11) = 3.08168 eV ==== + psi = 0.056*[# 6]+0.056*[# 8]+0.056*[# 14]+0.056*[# 15]+0.056*[# 31] + +0.056*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.021*[# 5]+0.021*[# 13]+0.021*[# 29]+0.016*[# 9] + +0.016*[# 17]+0.016*[# 21]+0.016*[# 25] + |psi|^2 = 0.991 +==== e( 12) = 3.08237 eV ==== + psi = 0.061*[# 1]+0.050*[# 7]+0.050*[# 16]+0.050*[# 30]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 18]+0.024*[# 19]+0.024*[# 20] + +0.024*[# 22]+0.024*[# 23]+0.024*[# 24]+0.024*[# 26]+0.024*[# 27] + +0.024*[# 28]+0.022*[# 6]+0.022*[# 8]+0.022*[# 14]+0.022*[# 15] + +0.022*[# 31]+0.022*[# 32]+0.016*[# 9]+0.016*[# 17]+0.016*[# 21] + +0.016*[# 25]+0.003*[# 2]+0.003*[# 3]+0.003*[# 4] + |psi|^2 = 0.703 +==== e( 13) = 4.86024 eV ==== + psi = 0.164*[# 7]+0.164*[# 16]+0.164*[# 30]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + + |psi|^2 = 0.988 +==== e( 14) = 4.86071 eV ==== + psi = 0.123*[# 6]+0.123*[# 8]+0.123*[# 14]+0.123*[# 15]+0.123*[# 31] + +0.123*[# 32]+0.062*[# 10]+0.062*[# 11]+0.062*[# 12]+0.062*[# 18] + +0.062*[# 19]+0.062*[# 20]+0.062*[# 22]+0.062*[# 23]+0.062*[# 24] + +0.062*[# 26]+0.062*[# 27]+0.062*[# 28] + |psi|^2 = 1.483 +==== e( 15) = 4.86155 eV ==== + psi = 0.082*[# 2]+0.082*[# 3]+0.082*[# 4]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14]+0.041*[# 15] + +0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23] + +0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.041*[# 31] + +0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 4.86155 eV ==== + psi = 0.082*[# 2]+0.082*[# 3]+0.082*[# 4]+0.082*[# 6]+0.082*[# 8] + +0.082*[# 14]+0.082*[# 15]+0.082*[# 31]+0.082*[# 32]+0.062*[# 10] + +0.062*[# 11]+0.062*[# 12]+0.062*[# 18]+0.062*[# 19]+0.062*[# 20] + +0.062*[# 22]+0.062*[# 23]+0.062*[# 24]+0.062*[# 26]+0.062*[# 27] + +0.062*[# 28] + |psi|^2 = 1.483 + + k = 0.6666666667 0.5000000000 0.8333333333 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20] + +0.014*[# 22]+0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27] + +0.014*[# 28]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 1.038 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4] + |psi|^2 = 0.948 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15] + +0.013*[# 31]+0.013*[# 32]+0.012*[# 10]+0.012*[# 11]+0.012*[# 12] + +0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22]+0.012*[# 23] + +0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28]+0.004*[# 7] + +0.004*[# 16]+0.004*[# 30] + |psi|^2 = 0.992 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.017*[# 7] + +0.017*[# 16]+0.017*[# 30] + |psi|^2 = 0.895 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.042*[# 7]+0.042*[# 16]+0.042*[# 30] + +0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.019*[# 1] + |psi|^2 = 1.020 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.031*[# 2] + +0.031*[# 3]+0.031*[# 4]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.001*[# 7] + +0.001*[# 16]+0.001*[# 30] + |psi|^2 = 0.923 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.032*[# 7]+0.032*[# 16] + +0.032*[# 30]+0.029*[# 1]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12] + +0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23] + +0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.024*[# 6] + +0.024*[# 8]+0.024*[# 14]+0.024*[# 15]+0.024*[# 31]+0.024*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.789 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31] + +0.027*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.954 +==== e( 12) = 3.70168 eV ==== + psi = 0.035*[# 6]+0.035*[# 8]+0.035*[# 14]+0.035*[# 15]+0.035*[# 31] + +0.035*[# 32]+0.028*[# 1]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.023*[# 2] + +0.023*[# 3]+0.023*[# 4]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.750 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.068*[# 6]+0.068*[# 8]+0.068*[# 14]+0.068*[# 15]+0.068*[# 31] + +0.068*[# 32]+0.054*[# 10]+0.054*[# 11]+0.054*[# 12]+0.054*[# 18] + +0.054*[# 19]+0.054*[# 20]+0.054*[# 22]+0.054*[# 23]+0.054*[# 24] + +0.054*[# 26]+0.054*[# 27]+0.054*[# 28]+0.040*[# 2]+0.040*[# 3] + +0.040*[# 4]+0.040*[# 7]+0.040*[# 16]+0.040*[# 30]+0.002*[# 1] + + |psi|^2 = 1.302 +==== e( 15) = 4.84656 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.977 +==== e( 16) = 4.84692 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.065*[# 6]+0.065*[# 8] + +0.065*[# 14]+0.065*[# 15]+0.065*[# 31]+0.065*[# 32]+0.053*[# 10] + +0.053*[# 11]+0.053*[# 12]+0.053*[# 18]+0.053*[# 19]+0.053*[# 20] + +0.053*[# 22]+0.053*[# 23]+0.053*[# 24]+0.053*[# 26]+0.053*[# 27] + +0.053*[# 28]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.290 + + k = 0.8333333333 0.5000000000 0.8333333333 +==== e( 1) = -4.52498 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.52394 eV ==== + psi = 0.179*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32]+0.012*[# 10] + +0.012*[# 11]+0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20] + +0.012*[# 22]+0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27] + +0.012*[# 28]+0.002*[# 2]+0.002*[# 3]+0.002*[# 4]+0.002*[# 7] + +0.002*[# 16]+0.002*[# 30] + |psi|^2 = 0.993 +==== e( 3) = -2.53521 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.875 +==== e( 4) = -2.53429 eV ==== + psi = 0.172*[# 1]+0.086*[# 9]+0.086*[# 17]+0.086*[# 21]+0.086*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.008*[# 7]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12] + +0.008*[# 16]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.008*[# 30]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.875 +==== e( 5) = -0.69955 eV ==== + psi = 0.078*[# 5]+0.078*[# 13]+0.078*[# 29]+0.059*[# 9]+0.059*[# 17] + +0.059*[# 21]+0.059*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.69934 eV ==== + psi = 0.117*[# 1]+0.059*[# 9]+0.059*[# 17]+0.059*[# 21]+0.059*[# 25] + +0.039*[# 5]+0.039*[# 13]+0.039*[# 29]+0.025*[# 2]+0.025*[# 3] + +0.025*[# 4]+0.025*[# 7]+0.025*[# 16]+0.025*[# 30]+0.022*[# 10] + +0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20] + +0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27] + +0.022*[# 28]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 7) = 1.70960 eV ==== + psi = 0.051*[# 5]+0.051*[# 13]+0.051*[# 29]+0.048*[# 7]+0.048*[# 16] + +0.048*[# 30]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.029*[# 1]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.020*[# 2] + +0.020*[# 3]+0.020*[# 4] + |psi|^2 = 1.035 +==== e( 8) = 1.71009 eV ==== + psi = 0.062*[# 1]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 14]+0.034*[# 15]+0.034*[# 31]+0.034*[# 32]+0.028*[# 10] + +0.028*[# 11]+0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20] + +0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27] + +0.028*[# 28]+0.023*[# 2]+0.023*[# 3]+0.023*[# 4]+0.021*[# 7] + +0.021*[# 16]+0.021*[# 30] + |psi|^2 = 1.035 +==== e( 9) = 2.10371 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.10436 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.050*[# 7]+0.050*[# 16] + +0.050*[# 30]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.017*[# 1] + +0.009*[# 9]+0.009*[# 17]+0.009*[# 21]+0.009*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 0.993 +==== e( 11) = 3.36740 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30] + |psi|^2 = 1.043 +==== e( 12) = 3.36742 eV ==== + psi = 0.067*[# 2]+0.067*[# 3]+0.067*[# 4]+0.056*[# 7]+0.056*[# 16] + +0.056*[# 30]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.001*[# 1] + + |psi|^2 = 1.043 +==== e( 13) = 4.14946 eV ==== + psi = 0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.028*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.988 +==== e( 14) = 4.14988 eV ==== + psi = 0.047*[# 2]+0.047*[# 3]+0.047*[# 4]+0.047*[# 7]+0.047*[# 16] + +0.047*[# 30]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.002*[# 1] + |psi|^2 = 0.988 +==== e( 15) = 4.40345 eV ==== + psi = 0.042*[# 7]+0.042*[# 16]+0.042*[# 30]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.030*[# 31] + +0.030*[# 32]+0.019*[# 2]+0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.728 +==== e( 16) = 4.40456 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.030*[# 31] + +0.030*[# 32] + |psi|^2 = 0.728 + + k = 0.0000000000 0.6666666667 0.8333333333 +==== e( 1) = -5.22585 eV ==== + psi = 0.100*[# 5]+0.100*[# 9]+0.100*[# 13]+0.100*[# 17]+0.100*[# 21] + +0.100*[# 25]+0.100*[# 29]+0.100*[# 1]+0.008*[# 2]+0.008*[# 3] + +0.008*[# 4]+0.008*[# 6]+0.008*[# 7]+0.008*[# 8]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 14]+0.008*[# 15]+0.008*[# 16] + +0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23] + +0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.008*[# 30] + +0.008*[# 31]+0.008*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.81827 eV ==== + psi = 0.082*[# 5]+0.082*[# 9]+0.082*[# 13]+0.082*[# 17]+0.082*[# 21] + +0.082*[# 25]+0.082*[# 29]+0.082*[# 1]+0.013*[# 2]+0.013*[# 3] + +0.013*[# 4]+0.013*[# 6]+0.013*[# 7]+0.013*[# 8]+0.013*[# 10] + +0.013*[# 11]+0.013*[# 12]+0.013*[# 14]+0.013*[# 15]+0.013*[# 16] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.013*[# 30] + +0.013*[# 31]+0.013*[# 32] + |psi|^2 = 0.983 +==== e( 3) = -2.58837 eV ==== + psi = 0.080*[# 5]+0.080*[# 9]+0.080*[# 13]+0.080*[# 17]+0.080*[# 21] + +0.080*[# 25]+0.080*[# 29]+0.079*[# 1]+0.003*[# 2]+0.003*[# 3] + +0.003*[# 4]+0.003*[# 6]+0.003*[# 7]+0.003*[# 8]+0.003*[# 10] + +0.003*[# 11]+0.003*[# 12]+0.003*[# 14]+0.003*[# 15]+0.003*[# 16] + +0.003*[# 18]+0.003*[# 19]+0.003*[# 20]+0.003*[# 22]+0.003*[# 23] + +0.003*[# 24]+0.003*[# 26]+0.003*[# 27]+0.003*[# 28]+0.003*[# 30] + +0.003*[# 31]+0.003*[# 32] + |psi|^2 = 0.708 +==== e( 4) = -2.01187 eV ==== + psi = 0.083*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.083*[# 5]+0.083*[# 13]+0.083*[# 29]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.911 +==== e( 5) = -1.10536 eV ==== + psi = 0.068*[# 1]+0.068*[# 5]+0.068*[# 13]+0.068*[# 29]+0.068*[# 9] + +0.068*[# 17]+0.068*[# 21]+0.068*[# 25]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.994 +==== e( 6) = -0.48760 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 9]+0.070*[# 13]+0.070*[# 17] + +0.070*[# 21]+0.070*[# 25]+0.070*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.021*[# 6]+0.021*[# 7]+0.021*[# 8]+0.021*[# 10] + +0.021*[# 11]+0.021*[# 12]+0.021*[# 14]+0.021*[# 15]+0.021*[# 16] + +0.021*[# 18]+0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23] + +0.021*[# 24]+0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.021*[# 30] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.053 +==== e( 7) = 0.97059 eV ==== + psi = 0.062*[# 1]+0.062*[# 5]+0.062*[# 9]+0.062*[# 13]+0.062*[# 17] + +0.062*[# 21]+0.062*[# 25]+0.062*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 6]+0.032*[# 7]+0.032*[# 8]+0.032*[# 10] + +0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15]+0.032*[# 16] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 30] + +0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.259 +==== e( 8) = 1.85450 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32] + |psi|^2 = 0.789 +==== e( 9) = 2.34633 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.040*[# 6]+0.040*[# 7] + +0.040*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14] + +0.040*[# 15]+0.040*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.040*[# 30]+0.040*[# 31]+0.040*[# 32]+0.004*[# 1] + +0.004*[# 5]+0.004*[# 9]+0.004*[# 13]+0.004*[# 17]+0.004*[# 21] + +0.004*[# 25]+0.004*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.97326 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.050*[# 6]+0.050*[# 7] + +0.050*[# 8]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 14] + +0.050*[# 15]+0.050*[# 16]+0.050*[# 18]+0.050*[# 19]+0.050*[# 20] + +0.050*[# 22]+0.050*[# 23]+0.050*[# 24]+0.050*[# 26]+0.050*[# 27] + +0.050*[# 28]+0.050*[# 30]+0.050*[# 31]+0.050*[# 32] + |psi|^2 = 1.198 +==== e( 11) = 3.29155 eV ==== + psi = 0.035*[# 7]+0.035*[# 16]+0.035*[# 30]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23] + +0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 0.865 +==== e( 12) = 3.36033 eV ==== + psi = 0.035*[# 2]+0.035*[# 3]+0.035*[# 4]+0.035*[# 6]+0.035*[# 7] + +0.035*[# 8]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 14] + +0.035*[# 15]+0.035*[# 16]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20] + +0.035*[# 22]+0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27] + +0.035*[# 28]+0.035*[# 30]+0.035*[# 31]+0.035*[# 32]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.846 +==== e( 13) = 3.42764 eV ==== + psi = 0.038*[# 1]+0.038*[# 5]+0.038*[# 9]+0.038*[# 13]+0.038*[# 17] + +0.038*[# 21]+0.038*[# 25]+0.038*[# 29]+0.028*[# 2]+0.028*[# 3] + +0.028*[# 4]+0.028*[# 6]+0.028*[# 8]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 14]+0.028*[# 15]+0.028*[# 18]+0.028*[# 19] + +0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24]+0.028*[# 26] + +0.028*[# 27]+0.028*[# 28]+0.028*[# 31]+0.028*[# 32]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 0.983 +==== e( 14) = 3.72790 eV ==== + psi = 0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.026*[# 6]+0.026*[# 7] + +0.026*[# 8]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 14] + +0.026*[# 15]+0.026*[# 16]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20] + +0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27] + +0.026*[# 28]+0.026*[# 30]+0.026*[# 31]+0.026*[# 32] + |psi|^2 = 0.634 +==== e( 15) = 4.50839 eV ==== + psi = 0.050*[# 2]+0.050*[# 3]+0.050*[# 4]+0.050*[# 6]+0.050*[# 7] + +0.050*[# 8]+0.050*[# 10]+0.050*[# 11]+0.050*[# 12]+0.050*[# 14] + +0.050*[# 15]+0.050*[# 16]+0.050*[# 18]+0.050*[# 19]+0.050*[# 20] + +0.050*[# 22]+0.050*[# 23]+0.050*[# 24]+0.050*[# 26]+0.050*[# 27] + +0.050*[# 28]+0.050*[# 30]+0.050*[# 31]+0.050*[# 32]+0.005*[# 1] + +0.005*[# 5]+0.005*[# 9]+0.005*[# 13]+0.005*[# 17]+0.005*[# 21] + +0.005*[# 25]+0.005*[# 29] + |psi|^2 = 1.248 +==== e( 16) = 5.45761 eV ==== + psi = 0.033*[# 2]+0.033*[# 3]+0.033*[# 4]+0.033*[# 6]+0.033*[# 7] + +0.033*[# 8]+0.033*[# 10]+0.033*[# 11]+0.033*[# 12]+0.033*[# 14] + +0.033*[# 15]+0.033*[# 16]+0.033*[# 18]+0.033*[# 19]+0.033*[# 20] + +0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26]+0.033*[# 27] + +0.033*[# 28]+0.033*[# 30]+0.033*[# 31]+0.033*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 0.818 + + k = 0.1666666667 0.6666666667 0.8333333333 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 1.011 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30]+0.008*[# 2]+0.008*[# 3]+0.008*[# 4]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20] + +0.008*[# 22]+0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27] + +0.008*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.855 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.048*[# 6]+0.048*[# 8]+0.048*[# 14]+0.048*[# 15]+0.048*[# 31] + +0.048*[# 32]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.034*[# 7]+0.034*[# 16] + +0.034*[# 30]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.883 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30] + |psi|^2 = 1.086 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.022*[# 2]+0.022*[# 3] + +0.022*[# 4]+0.018*[# 7]+0.018*[# 16]+0.018*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.948 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.034*[# 7]+0.034*[# 16]+0.034*[# 30]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 31] + +0.032*[# 32]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + |psi|^2 = 0.760 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.303 + + k = 0.3333333333 0.6666666667 0.8333333333 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4] + +0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30] + |psi|^2 = 1.070 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.004*[# 2] + +0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20] + +0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27] + +0.011*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.975 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.035*[# 2]+0.035*[# 3]+0.035*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.021*[# 31]+0.021*[# 32]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.925 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.029*[# 7] + +0.029*[# 16]+0.029*[# 30]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.922 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.026*[# 7]+0.026*[# 16]+0.026*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.868 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 6]+0.052*[# 8]+0.052*[# 14]+0.052*[# 15]+0.052*[# 31] + +0.052*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.036*[# 6]+0.036*[# 8]+0.036*[# 14]+0.036*[# 15]+0.036*[# 31] + +0.036*[# 32]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + |psi|^2 = 0.937 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.066*[# 7]+0.066*[# 16]+0.066*[# 30]+0.066*[# 2]+0.066*[# 3] + +0.066*[# 4]+0.055*[# 10]+0.055*[# 11]+0.055*[# 12]+0.055*[# 18] + +0.055*[# 19]+0.055*[# 20]+0.055*[# 22]+0.055*[# 23]+0.055*[# 24] + +0.055*[# 26]+0.055*[# 27]+0.055*[# 28]+0.044*[# 6]+0.044*[# 8] + +0.044*[# 14]+0.044*[# 15]+0.044*[# 31]+0.044*[# 32] + |psi|^2 = 1.330 +==== e( 15) = 4.45597 eV ==== + psi = 0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.016*[# 6]+0.016*[# 7] + +0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 14] + +0.016*[# 15]+0.016*[# 16]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 30]+0.016*[# 31]+0.016*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.450 +==== e( 16) = 5.48297 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 6]+0.062*[# 7] + +0.062*[# 8]+0.062*[# 10]+0.062*[# 11]+0.062*[# 12]+0.062*[# 14] + +0.062*[# 15]+0.062*[# 16]+0.062*[# 18]+0.062*[# 19]+0.062*[# 20] + +0.062*[# 22]+0.062*[# 23]+0.062*[# 24]+0.062*[# 26]+0.062*[# 27] + +0.062*[# 28]+0.062*[# 30]+0.062*[# 31]+0.062*[# 32] + |psi|^2 = 1.479 + + k = 0.5000000000 0.6666666667 0.8333333333 +==== e( 1) = -4.20920 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.089*[# 9]+0.089*[# 17] + +0.089*[# 21]+0.089*[# 25]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + +0.017*[# 2]+0.017*[# 3]+0.017*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.004*[# 6]+0.004*[# 8]+0.004*[# 14]+0.004*[# 15]+0.004*[# 31] + +0.004*[# 32] + |psi|^2 = 0.994 +==== e( 2) = -4.20816 eV ==== + psi = 0.178*[# 1]+0.089*[# 9]+0.089*[# 17]+0.089*[# 21]+0.089*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 14]+0.026*[# 15]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4]+0.018*[# 10]+0.018*[# 11]+0.018*[# 12] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28] + |psi|^2 = 1.152 +==== e( 3) = -3.10115 eV ==== + psi = 0.117*[# 5]+0.117*[# 13]+0.117*[# 29]+0.088*[# 9]+0.088*[# 17] + +0.088*[# 21]+0.088*[# 25]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30] + +0.010*[# 10]+0.010*[# 11]+0.010*[# 12]+0.010*[# 18]+0.010*[# 19] + +0.010*[# 20]+0.010*[# 22]+0.010*[# 23]+0.010*[# 24]+0.010*[# 26] + +0.010*[# 27]+0.010*[# 28]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4] + |psi|^2 = 0.948 +==== e( 4) = -3.10017 eV ==== + psi = 0.176*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.059*[# 5]+0.059*[# 13]+0.059*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12] + +0.017*[# 18]+0.017*[# 19]+0.017*[# 20]+0.017*[# 22]+0.017*[# 23] + +0.017*[# 24]+0.017*[# 26]+0.017*[# 27]+0.017*[# 28]+0.013*[# 2] + +0.013*[# 3]+0.013*[# 4] + |psi|^2 = 1.106 +==== e( 5) = -0.40986 eV ==== + psi = 0.054*[# 5]+0.054*[# 13]+0.054*[# 29]+0.048*[# 9]+0.048*[# 17] + +0.048*[# 21]+0.048*[# 25]+0.038*[# 7]+0.038*[# 16]+0.038*[# 30] + +0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12]+0.025*[# 18] + +0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23]+0.025*[# 24] + +0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2]+0.021*[# 3] + +0.021*[# 4]+0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15] + +0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.991 +==== e( 6) = -0.40951 eV ==== + psi = 0.067*[# 1]+0.048*[# 9]+0.048*[# 17]+0.048*[# 21]+0.048*[# 25] + +0.041*[# 5]+0.041*[# 13]+0.041*[# 29]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.024*[# 6]+0.024*[# 8]+0.024*[# 14]+0.024*[# 15] + +0.024*[# 31]+0.024*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.004*[# 7] + +0.004*[# 16]+0.004*[# 30] + |psi|^2 = 0.859 +==== e( 7) = 0.86715 eV ==== + psi = 0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.044*[# 9]+0.044*[# 17] + +0.044*[# 21]+0.044*[# 25]+0.042*[# 7]+0.042*[# 16]+0.042*[# 30] + +0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.028*[# 10]+0.028*[# 11] + +0.028*[# 12]+0.028*[# 18]+0.028*[# 19]+0.028*[# 20]+0.028*[# 22] + +0.028*[# 23]+0.028*[# 24]+0.028*[# 26]+0.028*[# 27]+0.028*[# 28] + +0.020*[# 6]+0.020*[# 8]+0.020*[# 14]+0.020*[# 15]+0.020*[# 31] + +0.020*[# 32]+0.019*[# 1] + |psi|^2 = 1.020 +==== e( 8) = 0.86772 eV ==== + psi = 0.069*[# 1]+0.044*[# 9]+0.044*[# 17]+0.044*[# 21]+0.044*[# 25] + +0.035*[# 5]+0.035*[# 13]+0.035*[# 29]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.022*[# 10] + +0.022*[# 11]+0.022*[# 12]+0.022*[# 18]+0.022*[# 19]+0.022*[# 20] + +0.022*[# 22]+0.022*[# 23]+0.022*[# 24]+0.022*[# 26]+0.022*[# 27] + +0.022*[# 28]+0.018*[# 2]+0.018*[# 3]+0.018*[# 4]+0.011*[# 7] + +0.011*[# 16]+0.011*[# 30] + |psi|^2 = 0.888 +==== e( 9) = 2.53458 eV ==== + psi = 0.054*[# 7]+0.054*[# 16]+0.054*[# 30]+0.041*[# 6]+0.041*[# 8] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 31]+0.041*[# 32]+0.037*[# 10] + +0.037*[# 11]+0.037*[# 12]+0.037*[# 18]+0.037*[# 19]+0.037*[# 20] + +0.037*[# 22]+0.037*[# 23]+0.037*[# 24]+0.037*[# 26]+0.037*[# 27] + +0.037*[# 28]+0.019*[# 5]+0.019*[# 13]+0.019*[# 29]+0.015*[# 9] + +0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.011*[# 2]+0.011*[# 3] + +0.011*[# 4] + |psi|^2 = 0.993 +==== e( 10) = 2.53536 eV ==== + psi = 0.032*[# 2]+0.032*[# 3]+0.032*[# 4]+0.030*[# 7]+0.030*[# 16] + +0.030*[# 30]+0.029*[# 1]+0.027*[# 10]+0.027*[# 11]+0.027*[# 12] + +0.027*[# 18]+0.027*[# 19]+0.027*[# 20]+0.027*[# 22]+0.027*[# 23] + +0.027*[# 24]+0.027*[# 26]+0.027*[# 27]+0.027*[# 28]+0.023*[# 6] + +0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.760 +==== e( 11) = 3.70118 eV ==== + psi = 0.060*[# 2]+0.060*[# 3]+0.060*[# 4]+0.035*[# 10]+0.035*[# 11] + +0.035*[# 12]+0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22] + +0.035*[# 23]+0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28] + +0.027*[# 6]+0.027*[# 8]+0.027*[# 14]+0.027*[# 15]+0.027*[# 31] + +0.027*[# 32]+0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25] + |psi|^2 = 0.954 +==== e( 12) = 3.70168 eV ==== + psi = 0.034*[# 6]+0.034*[# 8]+0.034*[# 14]+0.034*[# 15]+0.034*[# 31] + +0.034*[# 32]+0.028*[# 1]+0.025*[# 10]+0.025*[# 11]+0.025*[# 12] + +0.025*[# 18]+0.025*[# 19]+0.025*[# 20]+0.025*[# 22]+0.025*[# 23] + +0.025*[# 24]+0.025*[# 26]+0.025*[# 27]+0.025*[# 28]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4]+0.014*[# 9]+0.014*[# 17]+0.014*[# 21] + +0.014*[# 25]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.722 +==== e( 13) = 4.17298 eV ==== + psi = 0.067*[# 7]+0.067*[# 16]+0.067*[# 30]+0.043*[# 2]+0.043*[# 3] + +0.043*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.990 +==== e( 14) = 4.17314 eV ==== + psi = 0.073*[# 2]+0.073*[# 3]+0.073*[# 4]+0.071*[# 6]+0.071*[# 8] + +0.071*[# 14]+0.071*[# 15]+0.071*[# 31]+0.071*[# 32]+0.057*[# 10] + +0.057*[# 11]+0.057*[# 12]+0.057*[# 18]+0.057*[# 19]+0.057*[# 20] + +0.057*[# 22]+0.057*[# 23]+0.057*[# 24]+0.057*[# 26]+0.057*[# 27] + +0.057*[# 28]+0.013*[# 7]+0.013*[# 16]+0.013*[# 30]+0.002*[# 1] + + |psi|^2 = 1.371 +==== e( 15) = 4.84656 eV ==== + psi = 0.075*[# 7]+0.075*[# 16]+0.075*[# 30]+0.040*[# 10]+0.040*[# 11] + +0.040*[# 12]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22] + +0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28] + +0.029*[# 2]+0.029*[# 3]+0.029*[# 4]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.003*[# 5] + +0.003*[# 13]+0.003*[# 29]+0.002*[# 9]+0.002*[# 17]+0.002*[# 21] + +0.002*[# 25] + |psi|^2 = 0.977 +==== e( 16) = 4.84692 eV ==== + psi = 0.068*[# 6]+0.068*[# 8]+0.068*[# 14]+0.068*[# 15]+0.068*[# 31] + +0.068*[# 32]+0.056*[# 10]+0.056*[# 11]+0.056*[# 12]+0.056*[# 18] + +0.056*[# 19]+0.056*[# 20]+0.056*[# 22]+0.056*[# 23]+0.056*[# 24] + +0.056*[# 26]+0.056*[# 27]+0.056*[# 28]+0.049*[# 2]+0.049*[# 3] + +0.049*[# 4]+0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.004*[# 1] + +0.002*[# 9]+0.002*[# 17]+0.002*[# 21]+0.002*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.358 + + k = 0.6666666667 0.6666666667 0.8333333333 +==== e( 1) = -4.76657 eV ==== + psi = 0.094*[# 5]+0.094*[# 9]+0.094*[# 13]+0.094*[# 17]+0.094*[# 21] + +0.094*[# 25]+0.094*[# 29]+0.094*[# 1]+0.010*[# 2]+0.010*[# 3] + +0.010*[# 4]+0.010*[# 6]+0.010*[# 7]+0.010*[# 8]+0.010*[# 10] + +0.010*[# 11]+0.010*[# 12]+0.010*[# 14]+0.010*[# 15]+0.010*[# 16] + +0.010*[# 18]+0.010*[# 19]+0.010*[# 20]+0.010*[# 22]+0.010*[# 23] + +0.010*[# 24]+0.010*[# 26]+0.010*[# 27]+0.010*[# 28]+0.010*[# 30] + +0.010*[# 31]+0.010*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.46690 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.085*[# 9]+0.085*[# 17] + +0.085*[# 21]+0.085*[# 25]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4] + +0.016*[# 6]+0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 31]+0.016*[# 32]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30] + |psi|^2 = 1.070 +==== e( 3) = -3.46609 eV ==== + psi = 0.170*[# 1]+0.085*[# 9]+0.085*[# 17]+0.085*[# 21]+0.085*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.019*[# 7]+0.019*[# 16] + +0.019*[# 30]+0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15] + +0.014*[# 31]+0.014*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12] + +0.013*[# 18]+0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23] + +0.013*[# 24]+0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.004*[# 2] + +0.004*[# 3]+0.004*[# 4] + |psi|^2 = 0.994 +==== e( 4) = -2.76754 eV ==== + psi = 0.088*[# 1]+0.088*[# 9]+0.088*[# 17]+0.088*[# 21]+0.088*[# 25] + +0.088*[# 5]+0.088*[# 13]+0.088*[# 29]+0.015*[# 2]+0.015*[# 3] + +0.015*[# 4]+0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.011*[# 10] + +0.011*[# 11]+0.011*[# 12]+0.011*[# 18]+0.011*[# 19]+0.011*[# 20] + +0.011*[# 22]+0.011*[# 23]+0.011*[# 24]+0.011*[# 26]+0.011*[# 27] + +0.011*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.975 +==== e( 5) = -0.66030 eV ==== + psi = 0.051*[# 1]+0.051*[# 5]+0.051*[# 9]+0.051*[# 13]+0.051*[# 17] + +0.051*[# 21]+0.051*[# 25]+0.051*[# 29]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.024*[# 6]+0.024*[# 7]+0.024*[# 8]+0.024*[# 10] + +0.024*[# 11]+0.024*[# 12]+0.024*[# 14]+0.024*[# 15]+0.024*[# 16] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.024*[# 30] + +0.024*[# 31]+0.024*[# 32] + |psi|^2 = 0.992 +==== e( 6) = 0.11588 eV ==== + psi = 0.069*[# 5]+0.069*[# 13]+0.069*[# 29]+0.052*[# 9]+0.052*[# 17] + +0.052*[# 21]+0.052*[# 25]+0.035*[# 2]+0.035*[# 3]+0.035*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.021*[# 31]+0.021*[# 32]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.925 +==== e( 7) = 0.11599 eV ==== + psi = 0.103*[# 1]+0.052*[# 9]+0.052*[# 17]+0.052*[# 21]+0.052*[# 25] + +0.034*[# 5]+0.034*[# 13]+0.034*[# 29]+0.033*[# 6]+0.033*[# 8] + +0.033*[# 14]+0.033*[# 15]+0.033*[# 31]+0.033*[# 32]+0.029*[# 7] + +0.029*[# 16]+0.029*[# 30]+0.024*[# 10]+0.024*[# 11]+0.024*[# 12] + +0.024*[# 18]+0.024*[# 19]+0.024*[# 20]+0.024*[# 22]+0.024*[# 23] + +0.024*[# 24]+0.024*[# 26]+0.024*[# 27]+0.024*[# 28]+0.002*[# 2] + +0.002*[# 3]+0.002*[# 4] + |psi|^2 = 0.991 +==== e( 8) = 1.73698 eV ==== + psi = 0.039*[# 1]+0.039*[# 5]+0.039*[# 9]+0.039*[# 13]+0.039*[# 17] + +0.039*[# 21]+0.039*[# 25]+0.039*[# 29]+0.032*[# 2]+0.032*[# 3] + +0.032*[# 4]+0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.025*[# 10] + +0.025*[# 11]+0.025*[# 12]+0.025*[# 18]+0.025*[# 19]+0.025*[# 20] + +0.025*[# 22]+0.025*[# 23]+0.025*[# 24]+0.025*[# 26]+0.025*[# 27] + +0.025*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.922 +==== e( 9) = 2.21918 eV ==== + psi = 0.038*[# 2]+0.038*[# 3]+0.038*[# 4]+0.038*[# 6]+0.038*[# 7] + +0.038*[# 8]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 14] + +0.038*[# 15]+0.038*[# 16]+0.038*[# 18]+0.038*[# 19]+0.038*[# 20] + +0.038*[# 22]+0.038*[# 23]+0.038*[# 24]+0.038*[# 26]+0.038*[# 27] + +0.038*[# 28]+0.038*[# 30]+0.038*[# 31]+0.038*[# 32]+0.011*[# 1] + +0.011*[# 5]+0.011*[# 9]+0.011*[# 13]+0.011*[# 17]+0.011*[# 21] + +0.011*[# 25]+0.011*[# 29] + |psi|^2 = 0.993 +==== e( 10) = 2.90327 eV ==== + psi = 0.037*[# 2]+0.037*[# 3]+0.037*[# 4]+0.031*[# 6]+0.031*[# 8] + +0.031*[# 10]+0.031*[# 11]+0.031*[# 12]+0.031*[# 14]+0.031*[# 15] + +0.031*[# 18]+0.031*[# 19]+0.031*[# 20]+0.031*[# 22]+0.031*[# 23] + +0.031*[# 24]+0.031*[# 26]+0.031*[# 27]+0.031*[# 28]+0.031*[# 31] + +0.031*[# 32]+0.026*[# 7]+0.026*[# 16]+0.026*[# 30]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25] + |psi|^2 = 0.868 +==== e( 11) = 2.90345 eV ==== + psi = 0.052*[# 6]+0.052*[# 8]+0.052*[# 14]+0.052*[# 15]+0.052*[# 31] + +0.052*[# 32]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.029*[# 1]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.015*[# 9]+0.015*[# 17]+0.015*[# 21]+0.015*[# 25]+0.010*[# 5] + +0.010*[# 13]+0.010*[# 29] + |psi|^2 = 0.992 +==== e( 12) = 4.01552 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.039*[# 10]+0.039*[# 11] + +0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20]+0.039*[# 22] + +0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27]+0.039*[# 28] + +0.036*[# 6]+0.036*[# 8]+0.036*[# 14]+0.036*[# 15]+0.036*[# 31] + +0.036*[# 32]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4] + |psi|^2 = 0.937 +==== e( 13) = 4.01634 eV ==== + psi = 0.076*[# 2]+0.076*[# 3]+0.076*[# 4]+0.041*[# 10]+0.041*[# 11] + +0.041*[# 12]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20]+0.041*[# 22] + +0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27]+0.041*[# 28] + +0.032*[# 7]+0.032*[# 16]+0.032*[# 30]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.001*[# 1] + + |psi|^2 = 0.990 +==== e( 14) = 4.12428 eV ==== + psi = 0.066*[# 7]+0.066*[# 16]+0.066*[# 30]+0.066*[# 2]+0.066*[# 3] + +0.066*[# 4]+0.055*[# 10]+0.055*[# 11]+0.055*[# 12]+0.055*[# 18] + +0.055*[# 19]+0.055*[# 20]+0.055*[# 22]+0.055*[# 23]+0.055*[# 24] + +0.055*[# 26]+0.055*[# 27]+0.055*[# 28]+0.044*[# 6]+0.044*[# 8] + +0.044*[# 14]+0.044*[# 15]+0.044*[# 31]+0.044*[# 32] + |psi|^2 = 1.330 +==== e( 15) = 4.45597 eV ==== + psi = 0.016*[# 2]+0.016*[# 3]+0.016*[# 4]+0.016*[# 6]+0.016*[# 7] + +0.016*[# 8]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 14] + +0.016*[# 15]+0.016*[# 16]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.016*[# 30]+0.016*[# 31]+0.016*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.450 +==== e( 16) = 5.48297 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 6]+0.062*[# 7] + +0.062*[# 8]+0.062*[# 10]+0.062*[# 11]+0.062*[# 12]+0.062*[# 14] + +0.062*[# 15]+0.062*[# 16]+0.062*[# 18]+0.062*[# 19]+0.062*[# 20] + +0.062*[# 22]+0.062*[# 23]+0.062*[# 24]+0.062*[# 26]+0.062*[# 27] + +0.062*[# 28]+0.062*[# 30]+0.062*[# 31]+0.062*[# 32] + |psi|^2 = 1.479 + + k = 0.8333333333 0.6666666667 0.8333333333 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.014*[# 2]+0.014*[# 3] + +0.014*[# 4]+0.014*[# 6]+0.014*[# 7]+0.014*[# 8]+0.014*[# 10] + +0.014*[# 11]+0.014*[# 12]+0.014*[# 14]+0.014*[# 15]+0.014*[# 16] + +0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22]+0.014*[# 23] + +0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28]+0.014*[# 30] + +0.014*[# 31]+0.014*[# 32] + |psi|^2 = 1.011 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.009*[# 7]+0.009*[# 16] + +0.009*[# 30]+0.008*[# 2]+0.008*[# 3]+0.008*[# 4]+0.008*[# 10] + +0.008*[# 11]+0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20] + +0.008*[# 22]+0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27] + +0.008*[# 28]+0.007*[# 6]+0.007*[# 8]+0.007*[# 14]+0.007*[# 15] + +0.007*[# 31]+0.007*[# 32] + |psi|^2 = 0.855 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.023*[# 2]+0.023*[# 3] + +0.023*[# 4]+0.023*[# 7]+0.023*[# 16]+0.023*[# 30]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.018*[# 6]+0.018*[# 8]+0.018*[# 14]+0.018*[# 15] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.048*[# 6]+0.048*[# 8]+0.048*[# 14]+0.048*[# 15]+0.048*[# 31] + +0.048*[# 32]+0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.035*[# 18] + +0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23]+0.035*[# 24] + +0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.034*[# 7]+0.034*[# 16] + +0.034*[# 30]+0.011*[# 2]+0.011*[# 3]+0.011*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.883 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.027*[# 7] + +0.027*[# 16]+0.027*[# 30] + |psi|^2 = 1.086 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.022*[# 2]+0.022*[# 3] + +0.022*[# 4]+0.018*[# 7]+0.018*[# 16]+0.018*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.948 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.034*[# 7]+0.034*[# 16]+0.034*[# 30]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 14]+0.032*[# 15] + +0.032*[# 18]+0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23] + +0.032*[# 24]+0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.032*[# 31] + +0.032*[# 32]+0.030*[# 2]+0.030*[# 3]+0.030*[# 4] + |psi|^2 = 0.760 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.051*[# 2]+0.051*[# 3]+0.051*[# 4]+0.051*[# 6]+0.051*[# 7] + +0.051*[# 8]+0.051*[# 10]+0.051*[# 11]+0.051*[# 12]+0.051*[# 14] + +0.051*[# 15]+0.051*[# 16]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20] + +0.051*[# 22]+0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27] + +0.051*[# 28]+0.051*[# 30]+0.051*[# 31]+0.051*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 1.303 + + k = 0.0000000000 0.8333333333 0.8333333333 +==== e( 1) = -5.58652 eV ==== + psi = 0.112*[# 5]+0.112*[# 9]+0.112*[# 13]+0.112*[# 17]+0.112*[# 21] + +0.112*[# 25]+0.112*[# 29]+0.111*[# 1]+0.004*[# 2]+0.004*[# 3] + +0.004*[# 4]+0.004*[# 6]+0.004*[# 7]+0.004*[# 8]+0.004*[# 10] + +0.004*[# 11]+0.004*[# 12]+0.004*[# 14]+0.004*[# 15]+0.004*[# 16] + +0.004*[# 18]+0.004*[# 19]+0.004*[# 20]+0.004*[# 22]+0.004*[# 23] + +0.004*[# 24]+0.004*[# 26]+0.004*[# 27]+0.004*[# 28]+0.004*[# 30] + +0.004*[# 31]+0.004*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.80598 eV ==== + psi = 0.103*[# 5]+0.103*[# 13]+0.103*[# 29]+0.077*[# 9]+0.077*[# 17] + +0.077*[# 21]+0.077*[# 25]+0.009*[# 2]+0.009*[# 3]+0.009*[# 4] + +0.008*[# 6]+0.008*[# 8]+0.008*[# 14]+0.008*[# 15]+0.008*[# 31] + +0.008*[# 32]+0.008*[# 10]+0.008*[# 11]+0.008*[# 12]+0.008*[# 18] + +0.008*[# 19]+0.008*[# 20]+0.008*[# 22]+0.008*[# 23]+0.008*[# 24] + +0.008*[# 26]+0.008*[# 27]+0.008*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.812 +==== e( 3) = -2.80522 eV ==== + psi = 0.155*[# 1]+0.077*[# 9]+0.077*[# 17]+0.077*[# 21]+0.077*[# 25] + +0.052*[# 5]+0.052*[# 13]+0.052*[# 29]+0.016*[# 2]+0.016*[# 3] + +0.016*[# 4]+0.016*[# 7]+0.016*[# 16]+0.016*[# 30]+0.016*[# 10] + +0.016*[# 11]+0.016*[# 12]+0.016*[# 18]+0.016*[# 19]+0.016*[# 20] + +0.016*[# 22]+0.016*[# 23]+0.016*[# 24]+0.016*[# 26]+0.016*[# 27] + +0.016*[# 28]+0.015*[# 6]+0.015*[# 8]+0.015*[# 14]+0.015*[# 15] + +0.015*[# 31]+0.015*[# 32] + |psi|^2 = 0.994 +==== e( 4) = -1.80516 eV ==== + psi = 0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25]+0.079*[# 1] + +0.079*[# 5]+0.079*[# 13]+0.079*[# 29]+0.015*[# 7]+0.015*[# 16] + +0.015*[# 30]+0.015*[# 6]+0.015*[# 8]+0.015*[# 10]+0.015*[# 11] + +0.015*[# 12]+0.015*[# 14]+0.015*[# 15]+0.015*[# 18]+0.015*[# 19] + +0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24]+0.015*[# 26] + +0.015*[# 27]+0.015*[# 28]+0.015*[# 31]+0.015*[# 32]+0.014*[# 2] + +0.014*[# 3]+0.014*[# 4] + |psi|^2 = 0.987 +==== e( 5) = -1.40568 eV ==== + psi = 0.070*[# 1]+0.070*[# 5]+0.070*[# 13]+0.070*[# 29]+0.069*[# 9] + +0.069*[# 17]+0.069*[# 21]+0.069*[# 25]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.018*[# 6]+0.018*[# 7]+0.018*[# 8]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 14]+0.018*[# 15]+0.018*[# 16] + +0.018*[# 18]+0.018*[# 19]+0.018*[# 20]+0.018*[# 22]+0.018*[# 23] + +0.018*[# 24]+0.018*[# 26]+0.018*[# 27]+0.018*[# 28]+0.018*[# 30] + +0.018*[# 31]+0.018*[# 32] + |psi|^2 = 0.993 +==== e( 6) = -0.34433 eV ==== + psi = 0.092*[# 5]+0.092*[# 13]+0.092*[# 29]+0.069*[# 9]+0.069*[# 17] + +0.069*[# 21]+0.069*[# 25]+0.028*[# 6]+0.028*[# 8]+0.028*[# 14] + +0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20]+0.026*[# 22] + +0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27]+0.026*[# 28] + +0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.024*[# 7]+0.024*[# 16] + +0.024*[# 30] + |psi|^2 = 1.182 +==== e( 7) = -0.34382 eV ==== + psi = 0.138*[# 1]+0.069*[# 9]+0.069*[# 17]+0.069*[# 21]+0.069*[# 25] + +0.046*[# 5]+0.046*[# 13]+0.046*[# 29]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.018*[# 10] + +0.018*[# 11]+0.018*[# 12]+0.018*[# 18]+0.018*[# 19]+0.018*[# 20] + +0.018*[# 22]+0.018*[# 23]+0.018*[# 24]+0.018*[# 26]+0.018*[# 27] + +0.018*[# 28]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32] + |psi|^2 = 0.993 +==== e( 8) = 2.26764 eV ==== + psi = 0.027*[# 7]+0.027*[# 16]+0.027*[# 30]+0.026*[# 6]+0.026*[# 8] + +0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 14]+0.026*[# 15] + +0.026*[# 18]+0.026*[# 19]+0.026*[# 20]+0.026*[# 22]+0.026*[# 23] + +0.026*[# 24]+0.026*[# 26]+0.026*[# 27]+0.026*[# 28]+0.026*[# 31] + +0.026*[# 32]+0.024*[# 2]+0.024*[# 3]+0.024*[# 4]+0.001*[# 1] + +0.001*[# 5]+0.001*[# 9]+0.001*[# 13]+0.001*[# 17]+0.001*[# 21] + +0.001*[# 25]+0.001*[# 29] + |psi|^2 = 0.626 +==== e( 9) = 3.00585 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.034*[# 2]+0.034*[# 3] + +0.034*[# 4]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30]+0.005*[# 5] + +0.005*[# 13]+0.005*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 3.00589 eV ==== + psi = 0.098*[# 7]+0.098*[# 16]+0.098*[# 30]+0.051*[# 10]+0.051*[# 11] + +0.051*[# 12]+0.051*[# 18]+0.051*[# 19]+0.051*[# 20]+0.051*[# 22] + +0.051*[# 23]+0.051*[# 24]+0.051*[# 26]+0.051*[# 27]+0.051*[# 28] + +0.044*[# 2]+0.044*[# 3]+0.044*[# 4]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.007*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.002*[# 5] + +0.002*[# 13]+0.002*[# 29] + |psi|^2 = 1.243 +==== e( 11) = 3.20562 eV ==== + psi = 0.057*[# 6]+0.057*[# 8]+0.057*[# 14]+0.057*[# 15]+0.057*[# 31] + +0.057*[# 32]+0.039*[# 10]+0.039*[# 11]+0.039*[# 12]+0.039*[# 18] + +0.039*[# 19]+0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24] + +0.039*[# 26]+0.039*[# 27]+0.039*[# 28]+0.037*[# 7]+0.037*[# 16] + +0.037*[# 30]+0.006*[# 2]+0.006*[# 3]+0.006*[# 4] + |psi|^2 = 0.948 +==== e( 12) = 3.20630 eV ==== + psi = 0.096*[# 2]+0.096*[# 3]+0.096*[# 4]+0.050*[# 10]+0.050*[# 11] + +0.050*[# 12]+0.050*[# 18]+0.050*[# 19]+0.050*[# 20]+0.050*[# 22] + +0.050*[# 23]+0.050*[# 24]+0.050*[# 26]+0.050*[# 27]+0.050*[# 28] + +0.039*[# 7]+0.039*[# 16]+0.039*[# 30]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32] + |psi|^2 = 1.198 +==== e( 13) = 3.48375 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 7]+0.041*[# 6] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 16]+0.041*[# 11]+0.041*[# 12] + +0.041*[# 14]+0.041*[# 15]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 30]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26] + +0.041*[# 27]+0.041*[# 28]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 4.56822 eV ==== + psi = 0.026*[# 1]+0.026*[# 5]+0.026*[# 9]+0.026*[# 13]+0.026*[# 17] + +0.026*[# 21]+0.026*[# 25]+0.026*[# 29]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 0.663 +==== e( 15) = 5.28998 eV ==== + psi = 0.048*[# 2]+0.048*[# 3]+0.048*[# 4]+0.048*[# 6]+0.048*[# 7] + +0.048*[# 8]+0.048*[# 10]+0.048*[# 11]+0.048*[# 12]+0.048*[# 14] + +0.048*[# 15]+0.048*[# 16]+0.048*[# 18]+0.048*[# 19]+0.048*[# 20] + +0.048*[# 22]+0.048*[# 23]+0.048*[# 24]+0.048*[# 26]+0.048*[# 27] + +0.048*[# 28]+0.048*[# 30]+0.048*[# 31]+0.048*[# 32]+0.003*[# 1] + +0.003*[# 5]+0.003*[# 9]+0.003*[# 13]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25]+0.003*[# 29] + |psi|^2 = 1.166 +==== e( 16) = 6.05492 eV ==== + psi = 0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.026*[# 6]+0.026*[# 7] + +0.026*[# 8]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 14] + +0.026*[# 15]+0.026*[# 16]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20] + +0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27] + +0.026*[# 28]+0.026*[# 30]+0.026*[# 31]+0.026*[# 32] + |psi|^2 = 0.628 + + k = 0.1666666667 0.8333333333 0.8333333333 +==== e( 1) = -5.46675 eV ==== + psi = 0.107*[# 5]+0.107*[# 9]+0.107*[# 13]+0.107*[# 17]+0.107*[# 21] + +0.107*[# 25]+0.107*[# 29]+0.107*[# 1]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4]+0.006*[# 6]+0.006*[# 7]+0.006*[# 8]+0.006*[# 10] + +0.006*[# 11]+0.006*[# 12]+0.006*[# 14]+0.006*[# 15]+0.006*[# 16] + +0.006*[# 18]+0.006*[# 19]+0.006*[# 20]+0.006*[# 22]+0.006*[# 23] + +0.006*[# 24]+0.006*[# 26]+0.006*[# 27]+0.006*[# 28]+0.006*[# 30] + +0.006*[# 31]+0.006*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.013*[# 6]+0.013*[# 8]+0.013*[# 14]+0.013*[# 15]+0.013*[# 31] + +0.013*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18] + +0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24] + +0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.011*[# 7]+0.011*[# 16] + +0.011*[# 30] + |psi|^2 = 0.945 +==== e( 3) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.014*[# 2]+0.014*[# 3]+0.014*[# 4] + +0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15]+0.014*[# 31] + +0.014*[# 32]+0.013*[# 10]+0.013*[# 11]+0.013*[# 12]+0.013*[# 18] + +0.013*[# 19]+0.013*[# 20]+0.013*[# 22]+0.013*[# 23]+0.013*[# 24] + +0.013*[# 26]+0.013*[# 27]+0.013*[# 28]+0.010*[# 7]+0.010*[# 16] + +0.010*[# 30] + |psi|^2 = 0.939 +==== e( 4) = -2.74636 eV ==== + psi = 0.237*[# 1]+0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25] + +0.026*[# 5]+0.026*[# 13]+0.026*[# 29]+0.024*[# 7]+0.024*[# 16] + +0.024*[# 30]+0.019*[# 10]+0.019*[# 11]+0.019*[# 12]+0.019*[# 18] + +0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23]+0.019*[# 24] + +0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.018*[# 2]+0.018*[# 3] + +0.018*[# 4]+0.017*[# 6]+0.017*[# 8]+0.017*[# 14]+0.017*[# 15] + +0.017*[# 31]+0.017*[# 32] + |psi|^2 = 1.093 +==== e( 5) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.019*[# 10]+0.019*[# 11]+0.019*[# 12]+0.019*[# 18] + +0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23]+0.019*[# 24] + +0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.015*[# 2]+0.015*[# 3]+0.015*[# 4] + +0.015*[# 7]+0.015*[# 16]+0.015*[# 30]+0.014*[# 10]+0.014*[# 11] + +0.014*[# 12]+0.014*[# 18]+0.014*[# 19]+0.014*[# 20]+0.014*[# 22] + +0.014*[# 23]+0.014*[# 24]+0.014*[# 26]+0.014*[# 27]+0.014*[# 28] + +0.014*[# 6]+0.014*[# 8]+0.014*[# 14]+0.014*[# 15]+0.014*[# 31] + +0.014*[# 32] + |psi|^2 = 0.889 +==== e( 7) = -0.41176 eV ==== + psi = 0.204*[# 1]+0.068*[# 9]+0.068*[# 17]+0.068*[# 21]+0.068*[# 25] + +0.028*[# 7]+0.028*[# 16]+0.028*[# 30]+0.023*[# 5]+0.023*[# 13] + +0.023*[# 29]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12]+0.021*[# 18] + +0.021*[# 19]+0.021*[# 20]+0.021*[# 22]+0.021*[# 23]+0.021*[# 24] + +0.021*[# 26]+0.021*[# 27]+0.021*[# 28]+0.020*[# 2]+0.020*[# 3] + +0.020*[# 4]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.048 +==== e( 8) = 2.48448 eV ==== + psi = 0.041*[# 6]+0.041*[# 8]+0.041*[# 14]+0.041*[# 15]+0.041*[# 31] + +0.041*[# 32]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 18] + +0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23]+0.034*[# 24] + +0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.028*[# 7]+0.028*[# 16] + +0.028*[# 30]+0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.847 +==== e( 9) = 2.48448 eV ==== + psi = 0.056*[# 6]+0.056*[# 8]+0.056*[# 14]+0.056*[# 15]+0.056*[# 31] + +0.056*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.029*[# 7]+0.029*[# 16] + +0.029*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.48501 eV ==== + psi = 0.078*[# 7]+0.078*[# 16]+0.078*[# 30]+0.055*[# 2]+0.055*[# 3] + +0.055*[# 4]+0.042*[# 10]+0.042*[# 11]+0.042*[# 12]+0.042*[# 18] + +0.042*[# 19]+0.042*[# 20]+0.042*[# 22]+0.042*[# 23]+0.042*[# 24] + +0.042*[# 26]+0.042*[# 27]+0.042*[# 28]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.009*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 1.042 +==== e( 11) = 3.58915 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.985 +==== e( 12) = 3.58971 eV ==== + psi = 0.080*[# 2]+0.080*[# 3]+0.080*[# 4]+0.056*[# 7]+0.056*[# 16] + +0.056*[# 30]+0.045*[# 10]+0.045*[# 11]+0.045*[# 12]+0.045*[# 18] + +0.045*[# 19]+0.045*[# 20]+0.045*[# 22]+0.045*[# 23]+0.045*[# 24] + +0.045*[# 26]+0.045*[# 27]+0.045*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32] + |psi|^2 = 1.077 +==== e( 13) = 3.58971 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 7]+0.062*[# 16] + +0.062*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 3.76658 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.034*[# 6]+0.034*[# 8] + +0.035*[# 10]+0.035*[# 11]+0.035*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.035*[# 18]+0.035*[# 19]+0.035*[# 20]+0.035*[# 22]+0.035*[# 23] + +0.035*[# 24]+0.035*[# 26]+0.035*[# 27]+0.035*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.028*[# 1]+0.028*[# 5]+0.028*[# 9]+0.028*[# 13] + +0.028*[# 17]+0.028*[# 21]+0.028*[# 25]+0.028*[# 29]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 1.055 +==== e( 15) = 5.71627 eV ==== + psi = 0.049*[# 2]+0.049*[# 3]+0.049*[# 4]+0.049*[# 6]+0.049*[# 7] + +0.049*[# 8]+0.049*[# 10]+0.049*[# 11]+0.049*[# 12]+0.049*[# 14] + +0.049*[# 15]+0.049*[# 16]+0.049*[# 18]+0.049*[# 19]+0.049*[# 20] + +0.049*[# 22]+0.049*[# 23]+0.049*[# 24]+0.049*[# 26]+0.049*[# 27] + +0.049*[# 28]+0.049*[# 30]+0.049*[# 31]+0.049*[# 32] + |psi|^2 = 1.180 +==== e( 16) = 5.71627 eV ==== + psi = 0.026*[# 2]+0.026*[# 3]+0.026*[# 4]+0.026*[# 6]+0.026*[# 7] + +0.026*[# 8]+0.026*[# 10]+0.026*[# 11]+0.026*[# 12]+0.026*[# 14] + +0.026*[# 15]+0.026*[# 16]+0.026*[# 18]+0.026*[# 19]+0.026*[# 20] + +0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26]+0.026*[# 27] + +0.026*[# 28]+0.026*[# 30]+0.026*[# 31]+0.026*[# 32] + |psi|^2 = 0.624 + + k = 0.3333333333 0.8333333333 0.8333333333 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.118 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.136 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.026*[# 7]+0.026*[# 16] + +0.026*[# 30]+0.015*[# 10]+0.015*[# 11]+0.015*[# 12]+0.015*[# 18] + +0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24] + +0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.012*[# 6]+0.012*[# 8] + +0.012*[# 14]+0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4] + |psi|^2 = 0.853 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.020*[# 7]+0.020*[# 16] + +0.020*[# 30]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.743 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.045*[# 2]+0.045*[# 3]+0.045*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 1.070 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.985 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23] + +0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.040*[# 31] + +0.040*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.952 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.030*[# 6]+0.030*[# 7] + +0.030*[# 8]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14] + +0.030*[# 15]+0.030*[# 16]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.030*[# 30]+0.030*[# 31]+0.030*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.807 + + k = 0.5000000000 0.8333333333 0.8333333333 +==== e( 1) = -4.52498 eV ==== + psi = 0.119*[# 5]+0.119*[# 13]+0.119*[# 29]+0.090*[# 9]+0.090*[# 17] + +0.090*[# 21]+0.090*[# 25]+0.022*[# 7]+0.022*[# 16]+0.022*[# 30] + +0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.012*[# 10]+0.012*[# 11] + +0.012*[# 12]+0.012*[# 18]+0.012*[# 19]+0.012*[# 20]+0.012*[# 22] + +0.012*[# 23]+0.012*[# 24]+0.012*[# 26]+0.012*[# 27]+0.012*[# 28] + +0.002*[# 6]+0.002*[# 8]+0.002*[# 14]+0.002*[# 15]+0.002*[# 31] + +0.002*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -4.52394 eV ==== + psi = 0.179*[# 1]+0.090*[# 9]+0.090*[# 17]+0.090*[# 21]+0.090*[# 25] + +0.060*[# 5]+0.060*[# 13]+0.060*[# 29]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 14]+0.030*[# 15]+0.030*[# 31]+0.030*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12] + +0.020*[# 18]+0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23] + +0.020*[# 24]+0.020*[# 26]+0.020*[# 27]+0.020*[# 28] + |psi|^2 = 1.202 +==== e( 3) = -2.53521 eV ==== + psi = 0.114*[# 5]+0.114*[# 13]+0.114*[# 29]+0.086*[# 9]+0.086*[# 17] + +0.086*[# 21]+0.086*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.875 +==== e( 4) = -2.53429 eV ==== + psi = 0.172*[# 1]+0.086*[# 9]+0.086*[# 17]+0.086*[# 21]+0.086*[# 25] + +0.057*[# 5]+0.057*[# 13]+0.057*[# 29]+0.027*[# 7]+0.027*[# 16] + +0.027*[# 30]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12]+0.017*[# 18] + +0.017*[# 19]+0.017*[# 20]+0.017*[# 22]+0.017*[# 23]+0.017*[# 24] + +0.017*[# 26]+0.017*[# 27]+0.017*[# 28]+0.016*[# 6]+0.016*[# 8] + +0.016*[# 14]+0.016*[# 15]+0.016*[# 31]+0.016*[# 32]+0.008*[# 2] + +0.008*[# 3]+0.008*[# 4] + |psi|^2 = 1.084 +==== e( 5) = -0.69955 eV ==== + psi = 0.078*[# 5]+0.078*[# 13]+0.078*[# 29]+0.059*[# 9]+0.059*[# 17] + +0.059*[# 21]+0.059*[# 25]+0.031*[# 2]+0.031*[# 3]+0.031*[# 4] + +0.025*[# 6]+0.025*[# 8]+0.025*[# 14]+0.025*[# 15]+0.025*[# 31] + +0.025*[# 32]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12]+0.022*[# 18] + +0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23]+0.022*[# 24] + +0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7]+0.006*[# 16] + +0.006*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.69934 eV ==== + psi = 0.117*[# 1]+0.059*[# 9]+0.059*[# 17]+0.059*[# 21]+0.059*[# 25] + +0.039*[# 5]+0.039*[# 13]+0.039*[# 29]+0.029*[# 7]+0.029*[# 16] + +0.029*[# 30]+0.016*[# 10]+0.016*[# 11]+0.016*[# 12]+0.016*[# 18] + +0.016*[# 19]+0.016*[# 20]+0.016*[# 22]+0.016*[# 23]+0.016*[# 24] + +0.016*[# 26]+0.016*[# 27]+0.016*[# 28]+0.013*[# 6]+0.013*[# 8] + +0.013*[# 14]+0.013*[# 15]+0.013*[# 31]+0.013*[# 32]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4] + |psi|^2 = 0.856 +==== e( 7) = 1.70960 eV ==== + psi = 0.051*[# 5]+0.051*[# 13]+0.051*[# 29]+0.048*[# 7]+0.048*[# 16] + +0.048*[# 30]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.029*[# 1]+0.028*[# 10]+0.028*[# 11]+0.028*[# 12]+0.028*[# 18] + +0.028*[# 19]+0.028*[# 20]+0.028*[# 22]+0.028*[# 23]+0.028*[# 24] + +0.028*[# 26]+0.028*[# 27]+0.028*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.020*[# 2] + +0.020*[# 3]+0.020*[# 4] + |psi|^2 = 1.035 +==== e( 8) = 1.71009 eV ==== + psi = 0.062*[# 1]+0.046*[# 9]+0.046*[# 17]+0.046*[# 21]+0.046*[# 25] + +0.040*[# 5]+0.040*[# 13]+0.040*[# 29]+0.028*[# 6]+0.028*[# 8] + +0.028*[# 14]+0.028*[# 15]+0.028*[# 31]+0.028*[# 32]+0.027*[# 2] + +0.027*[# 3]+0.027*[# 4]+0.022*[# 10]+0.022*[# 11]+0.022*[# 12] + +0.022*[# 18]+0.022*[# 19]+0.022*[# 20]+0.022*[# 22]+0.022*[# 23] + +0.022*[# 24]+0.022*[# 26]+0.022*[# 27]+0.022*[# 28]+0.006*[# 7] + +0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.899 +==== e( 9) = 2.10371 eV ==== + psi = 0.050*[# 6]+0.050*[# 8]+0.050*[# 14]+0.050*[# 15]+0.050*[# 31] + +0.050*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 18]+0.039*[# 19]+0.039*[# 20] + +0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26]+0.039*[# 27] + +0.039*[# 28]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4]+0.009*[# 9]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.10436 eV ==== + psi = 0.050*[# 7]+0.050*[# 16]+0.050*[# 30]+0.045*[# 2]+0.045*[# 3] + +0.045*[# 4]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 18] + +0.036*[# 19]+0.036*[# 20]+0.036*[# 22]+0.036*[# 23]+0.036*[# 24] + +0.036*[# 26]+0.036*[# 27]+0.036*[# 28]+0.025*[# 6]+0.025*[# 8] + +0.025*[# 14]+0.025*[# 15]+0.025*[# 31]+0.025*[# 32]+0.017*[# 1] + +0.009*[# 9]+0.009*[# 17]+0.009*[# 21]+0.009*[# 25]+0.006*[# 5] + +0.006*[# 13]+0.006*[# 29] + |psi|^2 = 0.938 +==== e( 11) = 3.36740 eV ==== + psi = 0.061*[# 6]+0.061*[# 8]+0.061*[# 14]+0.061*[# 15]+0.061*[# 31] + +0.061*[# 32]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.037*[# 2]+0.037*[# 3] + +0.037*[# 4]+0.014*[# 7]+0.014*[# 16]+0.014*[# 30] + |psi|^2 = 1.043 +==== e( 12) = 3.36742 eV ==== + psi = 0.067*[# 2]+0.067*[# 3]+0.067*[# 4]+0.051*[# 7]+0.051*[# 16] + +0.051*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.023*[# 6]+0.023*[# 8] + +0.023*[# 14]+0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.001*[# 1] + + |psi|^2 = 0.988 +==== e( 13) = 4.14946 eV ==== + psi = 0.047*[# 6]+0.047*[# 8]+0.047*[# 14]+0.047*[# 15]+0.047*[# 31] + +0.047*[# 32]+0.044*[# 7]+0.044*[# 16]+0.044*[# 30]+0.036*[# 10] + +0.036*[# 11]+0.036*[# 12]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.028*[# 1]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.011*[# 5]+0.011*[# 13]+0.011*[# 29]+0.007*[# 2] + +0.007*[# 3]+0.007*[# 4] + |psi|^2 = 0.988 +==== e( 14) = 4.14988 eV ==== + psi = 0.056*[# 7]+0.056*[# 16]+0.056*[# 30]+0.052*[# 2]+0.052*[# 3] + +0.052*[# 4]+0.043*[# 10]+0.043*[# 11]+0.043*[# 12]+0.043*[# 18] + +0.043*[# 19]+0.043*[# 20]+0.043*[# 22]+0.043*[# 23]+0.043*[# 24] + +0.043*[# 26]+0.043*[# 27]+0.043*[# 28]+0.032*[# 6]+0.032*[# 8] + +0.032*[# 14]+0.032*[# 15]+0.032*[# 31]+0.032*[# 32]+0.019*[# 5] + +0.019*[# 13]+0.019*[# 29]+0.015*[# 9]+0.015*[# 17]+0.015*[# 21] + +0.015*[# 25]+0.002*[# 1] + |psi|^2 = 1.156 +==== e( 15) = 4.40345 eV ==== + psi = 0.042*[# 7]+0.042*[# 16]+0.042*[# 30]+0.030*[# 6]+0.030*[# 8] + +0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14]+0.030*[# 15] + +0.030*[# 18]+0.030*[# 19]+0.030*[# 20]+0.030*[# 22]+0.030*[# 23] + +0.030*[# 24]+0.030*[# 26]+0.030*[# 27]+0.030*[# 28]+0.030*[# 31] + +0.030*[# 32]+0.019*[# 2]+0.019*[# 3]+0.019*[# 4] + |psi|^2 = 0.728 +==== e( 16) = 4.40456 eV ==== + psi = 0.069*[# 2]+0.069*[# 3]+0.069*[# 4]+0.037*[# 6]+0.037*[# 8] + +0.037*[# 10]+0.037*[# 11]+0.037*[# 12]+0.037*[# 14]+0.037*[# 15] + +0.037*[# 18]+0.037*[# 19]+0.037*[# 20]+0.037*[# 22]+0.037*[# 23] + +0.037*[# 24]+0.037*[# 26]+0.037*[# 27]+0.037*[# 28]+0.037*[# 31] + +0.037*[# 32]+0.006*[# 7]+0.006*[# 16]+0.006*[# 30] + |psi|^2 = 0.896 + + k = 0.6666666667 0.8333333333 0.8333333333 +==== e( 1) = -5.11005 eV ==== + psi = 0.098*[# 5]+0.098*[# 9]+0.098*[# 13]+0.098*[# 17]+0.098*[# 21] + +0.098*[# 25]+0.098*[# 29]+0.098*[# 1]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 6]+0.009*[# 7]+0.009*[# 8]+0.009*[# 10] + +0.009*[# 11]+0.009*[# 12]+0.009*[# 14]+0.009*[# 15]+0.009*[# 16] + +0.009*[# 18]+0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23] + +0.009*[# 24]+0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.009*[# 30] + +0.009*[# 31]+0.009*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -3.72624 eV ==== + psi = 0.083*[# 5]+0.083*[# 9]+0.083*[# 13]+0.083*[# 17]+0.083*[# 21] + +0.083*[# 25]+0.083*[# 29]+0.083*[# 1]+0.019*[# 2]+0.019*[# 3] + +0.019*[# 4]+0.019*[# 6]+0.019*[# 7]+0.019*[# 8]+0.019*[# 10] + +0.019*[# 11]+0.019*[# 12]+0.019*[# 14]+0.019*[# 15]+0.019*[# 16] + +0.019*[# 18]+0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23] + +0.019*[# 24]+0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.019*[# 30] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.118 +==== e( 3) = -2.61387 eV ==== + psi = 0.111*[# 5]+0.111*[# 13]+0.111*[# 29]+0.083*[# 9]+0.083*[# 17] + +0.083*[# 21]+0.083*[# 25]+0.009*[# 6]+0.009*[# 8]+0.009*[# 14] + +0.009*[# 15]+0.009*[# 31]+0.009*[# 32]+0.008*[# 10]+0.008*[# 11] + +0.008*[# 12]+0.008*[# 18]+0.008*[# 19]+0.008*[# 20]+0.008*[# 22] + +0.008*[# 23]+0.008*[# 24]+0.008*[# 26]+0.008*[# 27]+0.008*[# 28] + +0.007*[# 2]+0.007*[# 3]+0.007*[# 4]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.855 +==== e( 4) = -2.61302 eV ==== + psi = 0.166*[# 1]+0.083*[# 9]+0.083*[# 17]+0.083*[# 21]+0.083*[# 25] + +0.055*[# 5]+0.055*[# 13]+0.055*[# 29]+0.021*[# 7]+0.021*[# 16] + +0.021*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.020*[# 10] + +0.020*[# 11]+0.020*[# 12]+0.020*[# 18]+0.020*[# 19]+0.020*[# 20] + +0.020*[# 22]+0.020*[# 23]+0.020*[# 24]+0.020*[# 26]+0.020*[# 27] + +0.020*[# 28]+0.019*[# 6]+0.019*[# 8]+0.019*[# 14]+0.019*[# 15] + +0.019*[# 31]+0.019*[# 32] + |psi|^2 = 1.136 +==== e( 5) = -0.58901 eV ==== + psi = 0.084*[# 5]+0.084*[# 13]+0.084*[# 29]+0.063*[# 9]+0.063*[# 17] + +0.063*[# 21]+0.063*[# 25]+0.028*[# 2]+0.028*[# 3]+0.028*[# 4] + +0.023*[# 6]+0.023*[# 8]+0.023*[# 14]+0.023*[# 15]+0.023*[# 31] + +0.023*[# 32]+0.020*[# 10]+0.020*[# 11]+0.020*[# 12]+0.020*[# 18] + +0.020*[# 19]+0.020*[# 20]+0.020*[# 22]+0.020*[# 23]+0.020*[# 24] + +0.020*[# 26]+0.020*[# 27]+0.020*[# 28]+0.008*[# 7]+0.008*[# 16] + +0.008*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.58871 eV ==== + psi = 0.126*[# 1]+0.063*[# 9]+0.063*[# 17]+0.063*[# 21]+0.063*[# 25] + +0.042*[# 5]+0.042*[# 13]+0.042*[# 29]+0.026*[# 7]+0.026*[# 16] + +0.026*[# 30]+0.015*[# 10]+0.015*[# 11]+0.015*[# 12]+0.015*[# 18] + +0.015*[# 19]+0.015*[# 20]+0.015*[# 22]+0.015*[# 23]+0.015*[# 24] + +0.015*[# 26]+0.015*[# 27]+0.015*[# 28]+0.012*[# 6]+0.012*[# 8] + +0.012*[# 14]+0.012*[# 15]+0.012*[# 31]+0.012*[# 32]+0.010*[# 2] + +0.010*[# 3]+0.010*[# 4] + |psi|^2 = 0.853 +==== e( 7) = 0.69477 eV ==== + psi = 0.058*[# 1]+0.058*[# 5]+0.058*[# 9]+0.058*[# 13]+0.058*[# 17] + +0.058*[# 21]+0.058*[# 25]+0.058*[# 29]+0.031*[# 7]+0.031*[# 16] + +0.031*[# 30]+0.026*[# 6]+0.026*[# 8]+0.026*[# 10]+0.026*[# 11] + +0.026*[# 12]+0.026*[# 14]+0.026*[# 15]+0.026*[# 18]+0.026*[# 19] + +0.026*[# 20]+0.026*[# 22]+0.026*[# 23]+0.026*[# 24]+0.026*[# 26] + +0.026*[# 27]+0.026*[# 28]+0.026*[# 31]+0.026*[# 32]+0.021*[# 2] + +0.021*[# 3]+0.021*[# 4] + |psi|^2 = 1.098 +==== e( 8) = 2.16363 eV ==== + psi = 0.042*[# 6]+0.042*[# 8]+0.042*[# 14]+0.042*[# 15]+0.042*[# 31] + +0.042*[# 32]+0.029*[# 10]+0.029*[# 11]+0.029*[# 12]+0.029*[# 18] + +0.029*[# 19]+0.029*[# 20]+0.029*[# 22]+0.029*[# 23]+0.029*[# 24] + +0.029*[# 26]+0.029*[# 27]+0.029*[# 28]+0.020*[# 7]+0.020*[# 16] + +0.020*[# 30]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.008*[# 5] + +0.008*[# 13]+0.008*[# 29]+0.006*[# 9]+0.006*[# 17]+0.006*[# 21] + +0.006*[# 25] + |psi|^2 = 0.743 +==== e( 9) = 2.16416 eV ==== + psi = 0.065*[# 2]+0.065*[# 3]+0.065*[# 4]+0.039*[# 7]+0.039*[# 10] + +0.039*[# 11]+0.039*[# 12]+0.039*[# 16]+0.039*[# 18]+0.039*[# 19] + +0.039*[# 20]+0.039*[# 22]+0.039*[# 23]+0.039*[# 24]+0.039*[# 26] + +0.039*[# 27]+0.039*[# 28]+0.039*[# 30]+0.027*[# 6]+0.027*[# 8] + +0.027*[# 14]+0.027*[# 15]+0.027*[# 31]+0.027*[# 32]+0.012*[# 1] + +0.006*[# 9]+0.006*[# 17]+0.006*[# 21]+0.006*[# 25]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29] + |psi|^2 = 0.994 +==== e( 10) = 2.71462 eV ==== + psi = 0.045*[# 2]+0.045*[# 3]+0.045*[# 4]+0.036*[# 1]+0.036*[# 5] + +0.036*[# 9]+0.036*[# 13]+0.036*[# 17]+0.036*[# 21]+0.036*[# 25] + +0.036*[# 29]+0.033*[# 6]+0.033*[# 8]+0.033*[# 10]+0.033*[# 11] + +0.033*[# 12]+0.033*[# 14]+0.033*[# 15]+0.033*[# 18]+0.033*[# 19] + +0.033*[# 20]+0.033*[# 22]+0.033*[# 23]+0.033*[# 24]+0.033*[# 26] + +0.033*[# 27]+0.033*[# 28]+0.033*[# 31]+0.033*[# 32]+0.020*[# 7] + +0.020*[# 16]+0.020*[# 30] + |psi|^2 = 1.070 +==== e( 11) = 3.13966 eV ==== + psi = 0.034*[# 2]+0.034*[# 3]+0.034*[# 4]+0.034*[# 6]+0.034*[# 7] + +0.034*[# 8]+0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14] + +0.034*[# 15]+0.034*[# 16]+0.034*[# 18]+0.034*[# 19]+0.034*[# 20] + +0.034*[# 22]+0.034*[# 23]+0.034*[# 24]+0.034*[# 26]+0.034*[# 27] + +0.034*[# 28]+0.034*[# 30]+0.034*[# 31]+0.034*[# 32]+0.009*[# 1] + +0.009*[# 5]+0.009*[# 9]+0.009*[# 13]+0.009*[# 17]+0.009*[# 21] + +0.009*[# 25]+0.009*[# 29] + |psi|^2 = 0.896 +==== e( 12) = 3.51483 eV ==== + psi = 0.060*[# 6]+0.060*[# 8]+0.060*[# 14]+0.060*[# 15]+0.060*[# 31] + +0.060*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.024*[# 2]+0.024*[# 3] + +0.024*[# 4]+0.020*[# 7]+0.020*[# 16]+0.020*[# 30]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.985 +==== e( 13) = 3.51499 eV ==== + psi = 0.064*[# 7]+0.064*[# 16]+0.064*[# 30]+0.056*[# 2]+0.056*[# 3] + +0.056*[# 4]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.022*[# 6]+0.022*[# 8] + +0.022*[# 14]+0.022*[# 15]+0.022*[# 31]+0.022*[# 32]+0.002*[# 1] + + |psi|^2 = 0.992 +==== e( 14) = 3.90225 eV ==== + psi = 0.059*[# 2]+0.059*[# 3]+0.059*[# 4]+0.040*[# 6]+0.040*[# 8] + +0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 14]+0.040*[# 15] + +0.040*[# 18]+0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23] + +0.040*[# 24]+0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.040*[# 31] + +0.040*[# 32]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.952 +==== e( 15) = 5.04912 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.041*[# 6]+0.041*[# 7] + +0.041*[# 8]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 14] + +0.041*[# 15]+0.041*[# 16]+0.041*[# 18]+0.041*[# 19]+0.041*[# 20] + +0.041*[# 22]+0.041*[# 23]+0.041*[# 24]+0.041*[# 26]+0.041*[# 27] + +0.041*[# 28]+0.041*[# 30]+0.041*[# 31]+0.041*[# 32] + |psi|^2 = 0.988 +==== e( 16) = 5.23066 eV ==== + psi = 0.030*[# 2]+0.030*[# 3]+0.030*[# 4]+0.030*[# 6]+0.030*[# 7] + +0.030*[# 8]+0.030*[# 10]+0.030*[# 11]+0.030*[# 12]+0.030*[# 14] + +0.030*[# 15]+0.030*[# 16]+0.030*[# 18]+0.030*[# 19]+0.030*[# 20] + +0.030*[# 22]+0.030*[# 23]+0.030*[# 24]+0.030*[# 26]+0.030*[# 27] + +0.030*[# 28]+0.030*[# 30]+0.030*[# 31]+0.030*[# 32]+0.010*[# 1] + +0.010*[# 5]+0.010*[# 9]+0.010*[# 13]+0.010*[# 17]+0.010*[# 21] + +0.010*[# 25]+0.010*[# 29] + |psi|^2 = 0.807 + + k = 0.8333333333 0.8333333333 0.8333333333 +==== e( 1) = -5.46675 eV ==== + psi = 0.107*[# 5]+0.107*[# 9]+0.107*[# 13]+0.107*[# 17]+0.107*[# 21] + +0.107*[# 25]+0.107*[# 29]+0.107*[# 1]+0.006*[# 2]+0.006*[# 3] + +0.006*[# 4]+0.006*[# 6]+0.006*[# 7]+0.006*[# 8]+0.006*[# 10] + +0.006*[# 11]+0.006*[# 12]+0.006*[# 14]+0.006*[# 15]+0.006*[# 16] + +0.006*[# 18]+0.006*[# 19]+0.006*[# 20]+0.006*[# 22]+0.006*[# 23] + +0.006*[# 24]+0.006*[# 26]+0.006*[# 27]+0.006*[# 28]+0.006*[# 30] + +0.006*[# 31]+0.006*[# 32] + |psi|^2 = 0.993 +==== e( 2) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.010*[# 6]+0.010*[# 8]+0.010*[# 14] + +0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.009*[# 2]+0.009*[# 3] + +0.009*[# 4]+0.009*[# 10]+0.009*[# 11]+0.009*[# 12]+0.009*[# 18] + +0.009*[# 19]+0.009*[# 20]+0.009*[# 22]+0.009*[# 23]+0.009*[# 24] + +0.009*[# 26]+0.009*[# 27]+0.009*[# 28]+0.007*[# 7]+0.007*[# 16] + +0.007*[# 30] + |psi|^2 = 0.844 +==== e( 3) = -2.74753 eV ==== + psi = 0.105*[# 5]+0.105*[# 13]+0.105*[# 29]+0.079*[# 9]+0.079*[# 17] + +0.079*[# 21]+0.079*[# 25]+0.025*[# 2]+0.025*[# 3]+0.025*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 10]+0.021*[# 11]+0.021*[# 12] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 18]+0.021*[# 19]+0.021*[# 20] + +0.021*[# 22]+0.021*[# 23]+0.021*[# 24]+0.021*[# 26]+0.021*[# 27] + +0.021*[# 28]+0.021*[# 31]+0.021*[# 32]+0.017*[# 7]+0.017*[# 16] + +0.017*[# 30] + |psi|^2 = 1.140 +==== e( 4) = -2.74636 eV ==== + psi = 0.237*[# 1]+0.079*[# 9]+0.079*[# 17]+0.079*[# 21]+0.079*[# 25] + +0.026*[# 5]+0.026*[# 13]+0.026*[# 29]+0.016*[# 7]+0.016*[# 16] + +0.016*[# 30]+0.011*[# 10]+0.011*[# 11]+0.011*[# 12]+0.011*[# 18] + +0.011*[# 19]+0.011*[# 20]+0.011*[# 22]+0.011*[# 23]+0.011*[# 24] + +0.011*[# 26]+0.011*[# 27]+0.011*[# 28]+0.010*[# 6]+0.010*[# 8] + +0.010*[# 14]+0.010*[# 15]+0.010*[# 31]+0.010*[# 32]+0.008*[# 2] + +0.008*[# 3]+0.008*[# 4] + |psi|^2 = 0.895 +==== e( 5) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.022*[# 2]+0.022*[# 3]+0.022*[# 4] + +0.021*[# 6]+0.021*[# 8]+0.021*[# 14]+0.021*[# 15]+0.021*[# 31] + +0.021*[# 32]+0.019*[# 10]+0.019*[# 11]+0.019*[# 12]+0.019*[# 18] + +0.019*[# 19]+0.019*[# 20]+0.019*[# 22]+0.019*[# 23]+0.019*[# 24] + +0.019*[# 26]+0.019*[# 27]+0.019*[# 28]+0.012*[# 7]+0.012*[# 16] + +0.012*[# 30] + |psi|^2 = 0.993 +==== e( 6) = -0.41244 eV ==== + psi = 0.090*[# 5]+0.090*[# 13]+0.090*[# 29]+0.068*[# 9]+0.068*[# 17] + +0.068*[# 21]+0.068*[# 25]+0.029*[# 2]+0.029*[# 3]+0.029*[# 4] + +0.023*[# 10]+0.023*[# 11]+0.023*[# 12]+0.023*[# 18]+0.023*[# 19] + +0.023*[# 20]+0.023*[# 22]+0.023*[# 23]+0.023*[# 24]+0.023*[# 26] + +0.023*[# 27]+0.023*[# 28]+0.023*[# 6]+0.023*[# 8]+0.023*[# 14] + +0.023*[# 15]+0.023*[# 31]+0.023*[# 32]+0.018*[# 7]+0.018*[# 16] + +0.018*[# 30] + |psi|^2 = 1.093 +==== e( 7) = -0.41176 eV ==== + psi = 0.204*[# 1]+0.068*[# 9]+0.068*[# 17]+0.068*[# 21]+0.068*[# 25] + +0.024*[# 7]+0.024*[# 16]+0.024*[# 30]+0.023*[# 5]+0.023*[# 13] + +0.023*[# 29]+0.017*[# 10]+0.017*[# 11]+0.017*[# 12]+0.017*[# 18] + +0.017*[# 19]+0.017*[# 20]+0.017*[# 22]+0.017*[# 23]+0.017*[# 24] + +0.017*[# 26]+0.017*[# 27]+0.017*[# 28]+0.015*[# 6]+0.015*[# 8] + +0.015*[# 14]+0.015*[# 15]+0.015*[# 31]+0.015*[# 32]+0.012*[# 2] + +0.012*[# 3]+0.012*[# 4] + |psi|^2 = 0.946 +==== e( 8) = 2.48448 eV ==== + psi = 0.049*[# 6]+0.049*[# 8]+0.049*[# 14]+0.049*[# 15]+0.049*[# 31] + +0.049*[# 32]+0.032*[# 10]+0.032*[# 11]+0.032*[# 12]+0.032*[# 18] + +0.032*[# 19]+0.032*[# 20]+0.032*[# 22]+0.032*[# 23]+0.032*[# 24] + +0.032*[# 26]+0.032*[# 27]+0.032*[# 28]+0.020*[# 7]+0.020*[# 16] + +0.020*[# 30]+0.013*[# 2]+0.013*[# 3]+0.013*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.803 +==== e( 9) = 2.48448 eV ==== + psi = 0.056*[# 6]+0.056*[# 8]+0.056*[# 14]+0.056*[# 15]+0.056*[# 31] + +0.056*[# 32]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.040*[# 18] + +0.040*[# 19]+0.040*[# 20]+0.040*[# 22]+0.040*[# 23]+0.040*[# 24] + +0.040*[# 26]+0.040*[# 27]+0.040*[# 28]+0.029*[# 7]+0.029*[# 16] + +0.029*[# 30]+0.020*[# 2]+0.020*[# 3]+0.020*[# 4]+0.004*[# 5] + +0.004*[# 13]+0.004*[# 29]+0.003*[# 9]+0.003*[# 17]+0.003*[# 21] + +0.003*[# 25] + |psi|^2 = 0.993 +==== e( 10) = 2.48501 eV ==== + psi = 0.067*[# 2]+0.067*[# 3]+0.067*[# 4]+0.048*[# 7]+0.048*[# 16] + +0.048*[# 30]+0.038*[# 10]+0.038*[# 11]+0.038*[# 12]+0.038*[# 18] + +0.038*[# 19]+0.038*[# 20]+0.038*[# 22]+0.038*[# 23]+0.038*[# 24] + +0.038*[# 26]+0.038*[# 27]+0.038*[# 28]+0.018*[# 6]+0.018*[# 8] + +0.018*[# 14]+0.018*[# 15]+0.018*[# 31]+0.018*[# 32]+0.009*[# 1] + +0.003*[# 9]+0.003*[# 17]+0.003*[# 21]+0.003*[# 25]+0.001*[# 5] + +0.001*[# 13]+0.001*[# 29] + |psi|^2 = 0.936 +==== e( 11) = 3.58915 eV ==== + psi = 0.058*[# 6]+0.058*[# 8]+0.058*[# 14]+0.058*[# 15]+0.058*[# 31] + +0.058*[# 32]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.027*[# 2]+0.027*[# 3] + +0.027*[# 4]+0.021*[# 7]+0.021*[# 16]+0.021*[# 30] + |psi|^2 = 0.985 +==== e( 12) = 3.58971 eV ==== + psi = 0.083*[# 2]+0.083*[# 3]+0.083*[# 4]+0.059*[# 7]+0.059*[# 16] + +0.059*[# 30]+0.046*[# 10]+0.046*[# 11]+0.046*[# 12]+0.046*[# 18] + +0.046*[# 19]+0.046*[# 20]+0.046*[# 22]+0.046*[# 23]+0.046*[# 24] + +0.046*[# 26]+0.046*[# 27]+0.046*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 1.101 +==== e( 13) = 3.58971 eV ==== + psi = 0.062*[# 2]+0.062*[# 3]+0.062*[# 4]+0.062*[# 7]+0.062*[# 16] + +0.062*[# 30]+0.041*[# 10]+0.041*[# 11]+0.041*[# 12]+0.041*[# 18] + +0.041*[# 19]+0.041*[# 20]+0.041*[# 22]+0.041*[# 23]+0.041*[# 24] + +0.041*[# 26]+0.041*[# 27]+0.041*[# 28]+0.021*[# 6]+0.021*[# 8] + +0.021*[# 14]+0.021*[# 15]+0.021*[# 31]+0.021*[# 32] + |psi|^2 = 0.994 +==== e( 14) = 3.76658 eV ==== + psi = 0.041*[# 2]+0.041*[# 3]+0.041*[# 4]+0.034*[# 6]+0.034*[# 8] + +0.034*[# 10]+0.034*[# 11]+0.034*[# 12]+0.034*[# 14]+0.034*[# 15] + +0.034*[# 18]+0.034*[# 19]+0.034*[# 20]+0.034*[# 22]+0.034*[# 23] + +0.034*[# 24]+0.034*[# 26]+0.034*[# 27]+0.034*[# 28]+0.034*[# 31] + +0.034*[# 32]+0.028*[# 1]+0.028*[# 5]+0.028*[# 9]+0.028*[# 13] + +0.028*[# 17]+0.028*[# 21]+0.028*[# 25]+0.028*[# 29]+0.028*[# 7] + +0.028*[# 16]+0.028*[# 30] + |psi|^2 = 1.053 +==== e( 15) = 5.71627 eV ==== + psi = 0.036*[# 2]+0.036*[# 3]+0.036*[# 4]+0.036*[# 6]+0.036*[# 7] + +0.036*[# 8]+0.036*[# 10]+0.036*[# 11]+0.036*[# 12]+0.036*[# 14] + +0.036*[# 15]+0.036*[# 16]+0.036*[# 18]+0.036*[# 19]+0.036*[# 20] + +0.036*[# 22]+0.036*[# 23]+0.036*[# 24]+0.036*[# 26]+0.036*[# 27] + +0.036*[# 28]+0.036*[# 30]+0.036*[# 31]+0.036*[# 32] + |psi|^2 = 0.855 +==== e( 16) = 5.71627 eV ==== + psi = 0.040*[# 2]+0.040*[# 3]+0.040*[# 4]+0.039*[# 6]+0.039*[# 7] + +0.039*[# 8]+0.040*[# 10]+0.040*[# 11]+0.040*[# 12]+0.039*[# 14] + +0.039*[# 15]+0.039*[# 16]+0.040*[# 18]+0.040*[# 19]+0.040*[# 20] + +0.040*[# 22]+0.040*[# 23]+0.040*[# 24]+0.040*[# 26]+0.040*[# 27] + +0.040*[# 28]+0.039*[# 30]+0.039*[# 31]+0.039*[# 32] + |psi|^2 = 0.948 + +Lowdin Charges: + + Atom # 1: total charge = 3.9064, s = 1.1923, + Atom # 1: total charge = 3.9064, p = 2.7141, pz= 0.9047, px= 0.9047, py= 0.9047, + Atom # 2: total charge = 3.9056, s = 1.1925, + Atom # 2: total charge = 3.9056, p = 2.7131, pz= 0.9020, px= 0.9090, py= 0.9020, + Atom # 3: total charge = 3.9201, s = 1.1927, + Atom # 3: total charge = 3.9201, p = 2.7275, pz= 0.9092, px= 0.9092, py= 0.9092, + Atom # 4: total charge = 3.9056, s = 1.1925, + Atom # 4: total charge = 3.9056, p = 2.7131, pz= 0.9020, px= 0.9020, py= 0.9090, + Atom # 5: total charge = 3.9201, s = 1.1927, + Atom # 5: total charge = 3.9201, p = 2.7275, pz= 0.9092, px= 0.9092, py= 0.9092, + Atom # 6: total charge = 3.9201, s = 1.1927, + Atom # 6: total charge = 3.9201, p = 2.7275, pz= 0.9092, px= 0.9092, py= 0.9092, + Atom # 7: total charge = 3.9201, s = 1.1927, + Atom # 7: total charge = 3.9201, p = 2.7275, pz= 0.9092, px= 0.9092, py= 0.9092, + Atom # 8: total charge = 3.9056, s = 1.1925, + Atom # 8: total charge = 3.9056, p = 2.7131, pz= 0.9090, px= 0.9020, py= 0.9020, + Spilling Parameter: 0.0218 + + PROJWFC : 0.91s CPU 1.05s WALL + + + This run was terminated on: 17:32: 5 16Jun2021 + +=------------------------------------------------------------------------------= + JOB DONE. +=------------------------------------------------------------------------------= diff --git a/docs/src/assets/job/Job2/scf.in b/docs/src/assets/job/Job2/scf.in new file mode 100644 index 00000000..dd9550b0 --- /dev/null +++ b/docs/src/assets/job/Job2/scf.in @@ -0,0 +1,39 @@ +&control + prefix = 'Si' + calculation = 'scf' + outdir = '/home/ponet/.julia/dev/DFControl/docs/src/assets/job/outputs' + pseudo_dir = '/home/ponet/Documents/pseudos/pslibrary_pbesol/PSEUDOPOTENTIALS' +/ + +&system + ibrav = 0 + nat = 8 + ntyp = 1 + ecutwfc = 20.0 +/ + +&electrons + conv_thr = 1.0e-6 +/ + +ATOMIC_SPECIES +Si 28.0855 Si.pbesol-n-kjpaw_psl.0.1.UPF + +CELL_PARAMETERS (angstrom) +5.4309401512146 0.0 0.0 +0.0 5.4309401512146 0.0 +0.0 0.0 5.4309401512146 + +ATOMIC_POSITIONS (crystal) +Si 0.0 0.0 0.0 +Si 0.0 0.5 0.5 +Si 0.25 0.25 0.25 +Si 0.5 0.0 0.5 +Si 0.25 0.75 0.75 +Si 0.75 0.75 0.25 +Si 0.75 0.25 0.75 +Si 0.5 0.5 0.0 + +K_POINTS (automatic) + 6 6 6 1 1 1 + diff --git a/docs/src/assets/job/Job2/scf.out b/docs/src/assets/job/Job2/scf.out new file mode 100644 index 00000000..af8c8dfb --- /dev/null +++ b/docs/src/assets/job/Job2/scf.out @@ -0,0 +1,291 @@ + + Program PWSCF v.6.7GPU starts on 16Jun2021 at 0:13:19 + + This program is part of the open-source Quantum ESPRESSO suite + for quantum simulation of materials; please cite + "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); + "P. Giannozzi et al., J. Phys.:Condens. Matter 29 465901 (2017); + "P. Giannozzi et al., J. Chem. Phys. 152 154105 (2020); + URL http://www.quantum-espresso.org", + in publications or presentations arising from this work. More details at + http://www.quantum-espresso.org/quote + + Parallel version (MPI), running on 4 processors + + MPI processes distributed on 1 nodes + K-points division: npool = 4 + Waiting for input... + Reading input from standard input + + Current dimensions of program PWSCF are: + Max number of different atomic species (ntypx) = 10 + Max number of k-points (npk) = 40000 + Max angular momentum in pseudopotentials (lmaxx) = 3 + file Si.pbesol-n-kjpaw_psl.0.1.UPF: wavefunction(s) 3S renormalized + Found symmetry operation: I + ( 0.0000 -0.5000 -0.5000) + This is a supercell, fractional translations are disabled + Message from routine setup: + using ibrav=0 with symmetry is DISCOURAGED, use correct ibrav instead + + Subspace diagonalization in iterative solution of the eigenvalue problem: + a serial algorithm will be used + + + G-vector sticks info + -------------------- + sticks: dense smooth PW G-vecs: dense smooth PW + Sum 673 673 197 13133 13133 2109 + + Using Slab Decomposition + + + + bravais-lattice index = 0 + lattice parameter (alat) = 10.2630 a.u. + unit-cell volume = 1080.9899 (a.u.)^3 + number of atoms/cell = 8 + number of atomic types = 1 + number of electrons = 32.00 + number of Kohn-Sham states= 16 + kinetic-energy cutoff = 20.0000 Ry + charge density cutoff = 80.0000 Ry + scf convergence threshold = 1.0E-06 + mixing beta = 0.7000 + number of iterations used = 8 plain mixing + Exchange-correlation= SLA PW PSX PSC + ( 1 4 10 8 0 0 0) + + celldm(1)= 10.262989 celldm(2)= 0.000000 celldm(3)= 0.000000 + celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 + + crystal axes: (cart. coord. in units of alat) + a(1) = ( 1.000000 0.000000 0.000000 ) + a(2) = ( 0.000000 1.000000 0.000000 ) + a(3) = ( 0.000000 0.000000 1.000000 ) + + reciprocal axes: (cart. coord. in units 2 pi/alat) + b(1) = ( 1.000000 0.000000 0.000000 ) + b(2) = ( 0.000000 1.000000 0.000000 ) + b(3) = ( 0.000000 0.000000 1.000000 ) + + + PseudoPot. # 1 for Si read from file: + /home/ponet/Documents/pseudos/pslibrary_pbesol/PSEUDOPOTENTIALS/Si.pbesol-n-kjpaw_psl.0.1.UPF + MD5 check sum: e112a9414d22b310a654c074e8da067c + Pseudo is Projector augmented-wave + core cor, Zval = 4.0 + Generated using "atomic" code by A. Dal Corso v.5.0.99 svn rev. 10869 + Shape of augmentation charge: PSQ + Using radial grid of 1141 points, 4 beta functions with: + l(1) = 0 + l(2) = 0 + l(3) = 1 + l(4) = 1 + Q(r) pseudized with 0 coefficients + + + atomic species valence mass pseudopotential + Si 4.00 28.08550 Si( 1.00) + + 24 Sym. Ops. (no inversion) found + + + + Cartesian axes + + site n. atom positions (alat units) + 1 Si tau( 1) = ( 0.0000000 0.0000000 0.0000000 ) + 2 Si tau( 2) = ( 0.0000000 0.5000000 0.5000000 ) + 3 Si tau( 3) = ( 0.2500000 0.2500000 0.2500000 ) + 4 Si tau( 4) = ( 0.5000000 0.0000000 0.5000000 ) + 5 Si tau( 5) = ( 0.2500000 0.7500000 0.7500000 ) + 6 Si tau( 6) = ( 0.7500000 0.7500000 0.2500000 ) + 7 Si tau( 7) = ( 0.7500000 0.2500000 0.7500000 ) + 8 Si tau( 8) = ( 0.5000000 0.5000000 0.0000000 ) + + number of k points= 10 + cart. coord. in units 2pi/alat + k( 1) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0740741 + k( 2) = ( 0.0833333 0.0833333 0.2500000), wk = 0.2222222 + k( 3) = ( 0.0833333 0.0833333 0.4166667), wk = 0.2222222 + k( 4) = ( 0.0833333 0.2500000 0.2500000), wk = 0.2222222 + k( 5) = ( 0.0833333 0.2500000 0.4166667), wk = 0.4444444 + k( 6) = ( 0.0833333 0.4166667 0.4166667), wk = 0.2222222 + k( 7) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0740741 + k( 8) = ( 0.2500000 0.2500000 0.4166667), wk = 0.2222222 + k( 9) = ( 0.2500000 0.4166667 0.4166667), wk = 0.2222222 + k( 10) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0740741 + + Dense grid: 13133 G-vectors FFT dimensions: ( 30, 30, 30) + + Estimated max dynamical RAM per process > 13.41 MB + + Estimated total dynamical RAM > 44.04 MB + + Check: negative core charge= -0.000010 + + Initial potential from superposition of free atoms + + starting charge 31.99568, renormalised to 32.00000 + Starting wfcs are 32 randomized atomic wfcs + Checking if some PAW data can be deallocated... + + total cpu time spent up to now is 0.3 secs + + Self-consistent Calculation + + iteration # 1 ecut= 20.00 Ry beta= 0.70 + Davidson diagonalization with overlap + ethr = 1.00E-02, avg # of iterations = 2.0 + + Threshold (ethr) on eigenvalues was too large: + Diagonalizing with lowered threshold + + Davidson diagonalization with overlap + ethr = 4.94E-04, avg # of iterations = 4.3 + + total cpu time spent up to now is 0.5 secs + + total energy = -365.09305388 Ry + estimated scf accuracy < 0.21516493 Ry + + iteration # 2 ecut= 20.00 Ry beta= 0.70 + Davidson diagonalization with overlap + ethr = 6.72E-04, avg # of iterations = 1.0 + + total cpu time spent up to now is 0.6 secs + + total energy = -365.10163516 Ry + estimated scf accuracy < 0.00953103 Ry + + iteration # 3 ecut= 20.00 Ry beta= 0.70 + Davidson diagonalization with overlap + ethr = 2.98E-05, avg # of iterations = 3.8 + + total cpu time spent up to now is 0.7 secs + + total energy = -365.10499152 Ry + estimated scf accuracy < 0.00028119 Ry + + iteration # 4 ecut= 20.00 Ry beta= 0.70 + Davidson diagonalization with overlap + ethr = 8.79E-07, avg # of iterations = 6.3 + + total cpu time spent up to now is 0.9 secs + + End of self-consistent calculation + + k = 0.0833 0.0833 0.0833 ( 1650 PWs) bands (ev): + + -5.7380 -2.2677 -2.2671 -2.2671 -0.9984 -0.9979 -0.9979 2.9547 + 2.9549 2.9549 3.3654 3.3654 3.3657 5.3022 6.0271 6.0271 + + k = 0.0833 0.0833 0.2500 ( 1636 PWs) bands (ev): + + -5.4956 -3.3804 -2.1719 -2.1714 -0.9888 -0.9885 0.3592 2.3623 + 2.3625 3.1610 3.1610 3.2286 3.5830 4.2271 5.3658 5.5594 + + k = 0.0833 0.0833 0.4167 ( 1631 PWs) bands (ev): + + -5.0149 -4.3047 -2.0600 -2.0595 -0.9964 -0.9961 1.7302 2.0240 + 2.0241 2.8162 2.8162 3.0298 3.7830 4.0097 4.6089 4.6239 + + k = 0.0833 0.2500 0.2500 ( 1629 PWs) bands (ev): + + -5.2577 -3.2089 -3.2084 -2.2715 -0.9081 0.1322 0.1324 1.8955 + 2.6931 2.6931 3.2051 3.5066 3.5069 3.7453 4.7617 5.8170 + + k = 0.0833 0.2500 0.4167 ( 1627 PWs) bands (ev): + + -4.7873 -4.0966 -2.8997 -2.5399 -0.6615 -0.2647 1.1798 1.8703 + 2.1787 2.1970 3.2619 3.4990 3.7163 3.9710 4.2301 5.1788 + + k = 0.0833 0.4167 0.4167 ( 1636 PWs) bands (ev): + + -4.3409 -3.6972 -3.6967 -3.1478 -0.1600 0.4772 0.4772 1.2845 + 2.0961 2.6061 2.6062 3.2242 4.4326 4.4945 4.4951 5.2344 + + k = 0.2500 0.2500 0.2500 ( 1637 PWs) bands (ev): + + -5.0261 -3.0970 -3.0963 -3.0963 -0.2396 -0.2395 -0.2395 2.2121 + 2.5861 2.5866 2.5866 3.9420 3.9420 3.9423 5.4035 5.4035 + + k = 0.2500 0.2500 0.4167 ( 1635 PWs) bands (ev): + + -4.5710 -3.9124 -2.9632 -2.9627 -0.5992 -0.5991 0.4661 1.2699 + 2.6557 2.6561 3.7053 3.9980 3.9980 4.3205 4.8389 4.8734 + + k = 0.2500 0.4167 0.4167 ( 1629 PWs) bands (ev): + + -4.1543 -3.5812 -3.5807 -3.2058 -0.6396 -0.2317 -0.2316 0.4142 + 3.1409 3.5749 3.5749 4.2965 4.5626 4.5970 4.5976 5.1697 + + k = 0.4167 0.4167 0.4167 ( 1640 PWs) bands (ev): + + -3.8190 -3.4432 -3.4424 -3.4424 -0.7470 -0.7470 -0.7468 -0.3414 + 4.3668 4.3675 4.3675 4.7818 4.7818 4.7821 5.0119 5.0119 + + highest occupied level (ev): 6.0271 + +! total energy = -365.10536476 Ry + + total all-electron energy = -4632.162294 Ry + estimated scf accuracy < 0.00000059 Ry + + The total energy is the sum of the following terms: + one-electron contribution = 22.97733890 Ry + hartree contribution = 4.30611190 Ry + xc contribution = -48.33476716 Ry + ewald contribution = -67.18414295 Ry + one-center paw contrib. = -276.86990545 Ry + + convergence has been achieved in 4 iterations + + Writing output data file /home/ponet/.julia/environments/DFControlDEV/outputs/Si.save/ + + init_run : 0.20s CPU 0.21s WALL ( 1 calls) + electrons : 0.65s CPU 0.66s WALL ( 1 calls) + + Called by init_run: + wfcinit : 0.05s CPU 0.05s WALL ( 1 calls) + potinit : 0.08s CPU 0.08s WALL ( 1 calls) + hinit0 : 0.06s CPU 0.07s WALL ( 1 calls) + + Called by electrons: + c_bands : 0.37s CPU 0.38s WALL ( 5 calls) + sum_band : 0.06s CPU 0.06s WALL ( 5 calls) + v_of_rho : 0.03s CPU 0.03s WALL ( 5 calls) + newd : 0.01s CPU 0.01s WALL ( 5 calls) + PAW_pot : 0.22s CPU 0.22s WALL ( 5 calls) + mix_rho : 0.00s CPU 0.00s WALL ( 5 calls) + + Called by c_bands: + init_us_2 : 0.01s CPU 0.01s WALL ( 33 calls) + cegterg : 0.34s CPU 0.35s WALL ( 15 calls) + + Called by *egterg: + cdiaghg : 0.01s CPU 0.01s WALL ( 69 calls) + h_psi : 0.31s CPU 0.31s WALL ( 75 calls) + s_psi : 0.02s CPU 0.02s WALL ( 75 calls) + g_psi : 0.00s CPU 0.00s WALL ( 57 calls) + + Called by h_psi: + h_psi:calbec : 0.02s CPU 0.02s WALL ( 75 calls) + vloc_psi : 0.26s CPU 0.27s WALL ( 75 calls) + add_vuspsi : 0.02s CPU 0.02s WALL ( 75 calls) + + General routines + calbec : 0.02s CPU 0.02s WALL ( 90 calls) + fft : 0.01s CPU 0.02s WALL ( 56 calls) + ffts : 0.00s CPU 0.00s WALL ( 5 calls) + fftw : 0.26s CPU 0.27s WALL ( 2016 calls) + + Parallel routines + + PWSCF : 0.90s CPU 0.93s WALL + + + This run was terminated on: 0:13:20 16Jun2021 + +=------------------------------------------------------------------------------= + JOB DONE. +=------------------------------------------------------------------------------= diff --git a/docs/src/guide/jobs.md b/docs/src/guide/jobs.md new file mode 100644 index 00000000..7b933982 --- /dev/null +++ b/docs/src/guide/jobs.md @@ -0,0 +1 @@ +# Jobs diff --git a/src/input.jl b/src/input.jl index eca5cda9..c5d29315 100644 --- a/src/input.jl +++ b/src/input.jl @@ -187,6 +187,9 @@ pdos(input::DFInput, args...) = Emin_from_projwfc(input::DFInput, args...) = @error "Emin_from_projwfc is not implemented for package $(package(input))." + +Base.joinpath(input::DFInput, args...) = joinpath(dir(input), args...) + include("qe/input.jl") include("elk/input.jl") include("wannier90/input.jl") diff --git a/src/job.jl b/src/job.jl index 1e9929e9..4dfe6628 100644 --- a/src/job.jl +++ b/src/job.jl @@ -250,7 +250,6 @@ searchdir(job::DFJob, str::AbstractString) = joinpath.((job,), searchdir(job.loc for f in (:cp, :mv) @eval function Base.$f(job::DFJob, dest::String; all=false, temp=false, kwargs...) - tjob = DFJob(job.local_dir) for file in readdir(job.local_dir) if !all if file == VERSION_DIR_NAME @@ -259,7 +258,10 @@ for f in (:cp, :mv) continue end end - $f(joinpath(tjob, file), joinpath(dest, file); kwargs...) + if joinpath(job, file) == abspath(dest) + continue + end + $f(joinpath(job, file), joinpath(dest, file); kwargs...) end end end diff --git a/src/qe/fileio.jl b/src/qe/fileio.jl index 2f82ca09..83467008 100644 --- a/src/qe/fileio.jl +++ b/src/qe/fileio.jl @@ -412,10 +412,10 @@ function qe_read_pdos(filename::String) end function qe_read_projwfc_output(input::DFInput{QE}, args...; kwargs...) - out = Dict{Symbol}() + out = Dict{Symbol, Any}() pdos_files = searchdir(dir(input), ".pdos_") if flag(input, :kresolveddos) == true - out[:heatmaps] = Vector{Matrix{Float64}}() + out[:heatmaps] = Vector{Matrix{Float64}}() out[:ytickvals] = Vector{Vector{Float64}}() out[:yticks] = Vector{Vector{Float64}}() for f in pdos_files diff --git a/src/qe/input.jl b/src/qe/input.jl index 9bd22fb0..a6664de6 100644 --- a/src/qe/input.jl +++ b/src/qe/input.jl @@ -181,7 +181,7 @@ function pdos(input::DFInput{QE}, atsym::Symbol, magnetic::Bool, soc::Bool, filt kresolved = hasflag(input, :kresolveddos) && input[:kresolveddos] files = filter(x->occursin("($atsym)",x) && occursin("#", x) && occursin(filter_word, x), searchdir(dir(input), "pdos")) @assert !isempty(files) "No pdos files found in input directory $(dir(input))" - + files = joinpath.((input,), files) energies, = kresolved ? qe_read_kpdos(files[1]) : qe_read_pdos(files[1]) atdos = magnetic && !soc ? zeros(size(energies, 1), 2) : zeros(size(energies, 1)) if kresolved diff --git a/test/job_control_tests.jl b/test/job_control_tests.jl index 2cf5d77c..0da7577a 100644 --- a/test/job_control_tests.jl +++ b/test/job_control_tests.jl @@ -36,7 +36,6 @@ set_kpoints!(nscf2, (3,3,3,0,0,1), print=false) @test data(nscf2, :k_points).option == :automatic @test data(nscf2, :k_points).data == [3,3,3,0,0,1] -@show outputdata(job, "nscf") fermi = outputdata(job, "nscf")[:fermi] @test fermi == 17.4572 @@ -286,7 +285,6 @@ set_magnetization!(job, :Pt => [0, 0, 1]) orig_projs = projections(atoms(job, :Pt)[1]) job.structure = create_supercell(structure(job), 1, 0, 0, make_afm=true) -@show atoms(job) DFControl.sanitize_magnetization!(job) DFControl.set_starting_magnetization_flags!.(filter(x -> DFControl.package(x) == QE, DFControl.inputs(job)), (job.structure,)) @test length(atoms(job, :Pt)) == prevlen_Pt