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ldos00.dat
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ldos00.dat
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# Fermi level (eV): -11.430
# Charge transfer : 0.011
# Electron counts for each orbital momentum:
# 0 1.887
# 1 5.030
# 2 0.069
# 3 0.000
# Number of atoms in cluster: 208
# Lorentzian broadening with HWHH 0.1000 eV
# -----------------------------------------------------------------------
# e sDOS pDOS dDOS fDOS @#
-30.0000 6.499018E-03 1.497322E-03 1.074053E-04 5.436966E-05
-29.5500 4.702051E-03 1.579481E-03 1.057544E-04 5.415049E-05
-29.1000 3.665257E-03 1.711071E-03 1.072261E-04 5.463803E-05
-28.6500 2.955918E-03 1.868576E-03 1.092310E-04 5.524752E-05
-28.2000 2.440919E-03 2.052572E-03 1.114715E-04 5.591441E-05
-27.7500 2.053268E-03 2.267568E-03 1.138886E-04 5.662834E-05
-27.3000 1.753654E-03 2.520172E-03 1.164485E-04 5.737155E-05
-26.8500 1.517202E-03 2.819588E-03 1.191769E-04 5.815979E-05
-26.4000 1.327392E-03 3.178072E-03 1.220839E-04 5.899429E-05
-25.9500 1.172768E-03 3.612063E-03 1.251429E-04 5.984941E-05
-25.5000 1.045381E-03 4.145186E-03 1.284614E-04 6.078587E-05
-25.0500 9.392843E-04 4.809655E-03 1.319768E-04 6.175170E-05
-24.6000 8.501876E-04 5.653256E-03 1.357272E-04 6.275735E-05
-24.1500 7.749414E-04 6.747262E-03 1.397946E-04 6.383502E-05
-23.7000 7.111610E-04 8.205055E-03 1.443493E-04 6.507168E-05
-23.2500 6.567741E-04 1.020333E-02 1.491008E-04 6.625080E-05
-22.8000 6.107388E-04 1.306142E-02 1.546597E-04 6.770823E-05
-22.3500 5.719480E-04 1.735161E-02 1.609681E-04 6.934677E-05
-21.9000 5.397613E-04 2.422330E-02 1.679840E-04 7.104515E-05
-21.4500 5.142005E-04 3.630728E-02 1.765151E-04 7.310112E-05
-21.0000 4.957880E-04 6.063835E-02 1.869362E-04 7.536910E-05
-20.5500 4.872683E-04 1.223811E-01 2.044662E-04 7.986186E-05
-20.1000 4.909453E-04 3.647340E-01 2.300378E-04 8.182752E-05
-19.6500 5.269927E-04 4.319425E+00 5.549873E-04 1.312699E-04
-19.2000 6.410774E-04 1.079756E+00 2.789184E-04 7.203013E-05
-18.7500 -1.403900E-03 -6.521324E-01 -5.868227E-03 -5.730959E-04
-18.3000 1.258955E-02 3.622941E-01 2.065254E-03 5.968222E-04
-17.8500 6.927708E-03 4.834567E-01 1.415558E-03 3.148107E-04
-17.4000 2.028000E-03 3.381237E-01 2.029506E-03 3.559559E-04
-16.9500 1.310382E-03 1.495862E-01 2.887042E-03 6.974658E-04
-16.5000 8.964671E-04 6.885459E-02 1.686291E-03 5.263821E-04
-16.0500 5.693533E-04 2.313206E-02 5.472539E-04 1.666119E-04
-15.6000 5.242313E-04 1.553060E-02 5.182501E-04 1.516935E-04
-15.1500 5.405388E-04 1.226808E-02 6.004502E-04 1.655534E-04
-14.7000 5.994000E-04 1.069858E-02 7.821733E-04 1.972065E-04
-14.2500 7.178967E-04 1.046876E-02 1.188950E-03 2.607217E-04
-13.8000 9.605703E-04 1.271013E-02 2.494881E-03 4.210790E-04
-13.3500 1.751609E-03 3.416603E-02 1.615516E-02 1.390011E-03
-12.9000 5.860062E-03 1.134839E-01 4.151976E-02 5.432051E-03
-12.4500 1.299280E-02 1.797680E-01 4.552625E-02 1.220049E-02
-12.0000 4.859352E-02 1.951583E-01 1.688136E-02 9.017549E-03
-11.5500 3.983260E-02 2.355319E-01 2.053863E-02 1.038648E-02
-11.1000 1.363331E-02 1.811238E-01 1.467970E-02 5.629684E-03
-10.6500 5.736367E-03 8.608638E-02 5.647893E-03 1.871377E-03
-10.2000 1.007921E-02 3.544893E-02 1.733499E-03 6.077604E-04
-9.7500 2.114885E-02 2.533436E-02 1.319193E-03 3.802919E-04
-9.3000 2.656538E-02 2.833042E-02 1.326010E-03 3.194332E-04
-8.8500 2.179316E-02 4.084540E-02 1.537175E-03 3.128656E-04
-8.4000 1.894024E-02 5.718134E-02 2.106995E-03 3.276595E-04
-7.9500 2.510103E-02 6.288929E-02 3.829628E-03 3.812578E-04
-7.5000 3.386470E-02 5.876939E-02 7.057970E-03 4.677901E-04
-7.0500 2.239428E-02 6.386487E-02 7.145822E-03 5.355053E-04
-6.6000 1.378004E-02 6.547353E-02 7.195023E-03 5.353898E-04
-6.1500 9.965663E-03 6.294674E-02 1.049185E-02 6.026419E-04
-5.7000 9.079644E-03 6.777867E-02 1.116878E-02 6.248353E-04
-5.2500 1.024551E-02 9.281560E-02 1.122385E-02 6.402644E-04
-4.8000 1.096531E-02 1.163616E-01 1.522313E-02 7.941070E-04
-4.3500 1.332062E-02 1.064294E-01 2.294268E-02 1.075204E-03
-3.9000 8.019183E-03 7.176905E-02 2.772211E-02 1.235526E-03
-3.4500 6.011442E-03 4.468137E-02 2.050155E-02 1.022686E-03
-3.0000 6.903524E-03 4.584363E-02 1.857739E-02 1.125453E-03
-2.5500 9.153584E-03 6.936681E-02 2.427257E-02 1.443041E-03
-2.1000 1.022712E-02 9.424354E-02 3.870428E-02 2.151048E-03
-1.6500 8.555378E-03 7.375571E-02 4.616901E-02 2.580592E-03
-1.2000 6.498744E-03 5.469226E-02 4.314726E-02 2.553651E-03
-0.7500 5.273669E-03 4.367504E-02 4.228200E-02 2.511438E-03
-0.3000 4.791216E-03 3.713196E-02 4.900083E-02 2.578824E-03
0.1500 4.797912E-03 3.426491E-02 5.855763E-02 2.970093E-03
0.6000 5.219911E-03 3.549944E-02 5.477839E-02 3.811836E-03
1.0500 6.099076E-03 3.752097E-02 4.515736E-02 4.747252E-03
1.5000 7.435517E-03 3.246082E-02 3.686558E-02 4.313194E-03
1.9500 9.348537E-03 2.899817E-02 3.246141E-02 4.145547E-03
2.4000 1.186919E-02 2.809288E-02 3.158327E-02 4.750408E-03
2.8500 1.307905E-02 2.814234E-02 3.272666E-02 5.943711E-03
3.3000 1.083265E-02 2.810558E-02 3.321751E-02 7.004631E-03
3.7500 8.016898E-03 2.674123E-02 3.062906E-02 7.059838E-03
4.2000 6.901305E-03 2.441589E-02 2.817391E-02 6.740490E-03
4.6500 6.824071E-03 2.248783E-02 2.734759E-02 6.497193E-03
5.1000 7.237390E-03 2.172805E-02 2.777939E-02 6.441565E-03
5.5500 8.025324E-03 2.234800E-02 2.938409E-02 6.691494E-03
6.0000 9.280941E-03 2.435177E-02 3.239315E-02 7.321084E-03
6.4500 1.128192E-02 2.740305E-02 3.695468E-02 8.305452E-03
6.9000 1.424803E-02 3.043393E-02 4.240361E-02 9.397047E-03
7.3500 1.769087E-02 3.265653E-02 4.665059E-02 1.009796E-02
7.8000 2.097705E-02 3.686953E-02 4.950305E-02 1.063647E-02
8.2500 2.399614E-02 4.905841E-02 5.334108E-02 1.185859E-02
8.7000 2.408716E-02 5.009208E-02 5.510745E-02 1.153407E-02
9.1500 2.216230E-02 5.480179E-02 5.628238E-02 1.040718E-02
9.6000 2.000452E-02 6.363093E-02 5.726856E-02 9.575221E-03
10.0500 1.838256E-02 6.868572E-02 6.124241E-02 8.969301E-03
10.5000 1.726321E-02 7.060957E-02 7.155574E-02 8.853369E-03
10.9500 1.666224E-02 6.354882E-02 8.159106E-02 9.187619E-03
11.4000 1.661808E-02 5.607306E-02 9.688319E-02 9.671146E-03
11.8500 1.698614E-02 5.320076E-02 1.275817E-01 9.901087E-03
12.3000 1.729985E-02 5.364605E-02 1.434002E-01 9.984388E-03
12.7500 1.707144E-02 5.351853E-02 1.343403E-01 1.018959E-02
13.2000 1.625848E-02 5.580898E-02 1.332404E-01 1.050821E-02
13.6500 1.499074E-02 6.352361E-02 1.420136E-01 1.104912E-02
14.1000 1.358525E-02 7.672363E-02 1.502347E-01 1.178977E-02
14.5500 1.302492E-02 8.588340E-02 1.528904E-01 1.274586E-02
15.0000 1.356520E-02 7.989365E-02 1.508979E-01 1.372600E-02