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Scripts developed for SKIF-Ural, SKIF-Aurora and Tornado supercomputers
Shell Python C++
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cpp
python
DOS_analyze.sh
README.md
all_structs
backrun
calc_clean
configure_int
det4x4
distance_from_H
dos_generate
dos_norm
dos_plot
eplot_auto
eplot_png
find_energy.sh
find_energy2.sh
find_energy3.sh
find_energy_partial_H.sh
get_atoms_shift.sh
html_gen
magn_moments
make_report
max_force
max_force_boa
max_force_coa
meminfo
meminfo.log
mmFeNi.py
mydaemon
mynodes
mynodes_ib
mynodes_local
node_test
qcd
qcheck
qdates
qday
qdel_tasks
qdone
qdone_disable
qdos
qforce
qfree
qjob
qlabel
qmachines
qmail
qmon
qmon_disable
qmyjob
qmystat
qmysub
qnode
qrename
qrerun
qres
qres_fast
qrestore
qrun
qskill
qstat_list
qstruct
qtest.sh
qtop
qtop_dups
qtop_ib
qtop_private
qtrans
qusers
qzip
qzkill
settol_problem_solver.sh
spheres_parser
spheres_parser_rel
struct2rsm
struct2rsm_3C
struct2rsm_C
struct2rsm_anim
struct2rsm_new2.py
struct2rsm_newXH.py
struct2rsm_part
struct2rsm_sgroup
struct2rsm_vac
struct2xls.py
time_diff
volopt_info
volopt_info_boa
volopt_info_coa
wien2k08_init_lapw
xyz_struct.py

README.md

skif-bin

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