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mirror of https://github.com/triqs/dft_tools synced 2024-12-22 04:13:47 +01:00
dft_tools/python/vasp
Oleg E. Peil cefaf9dda4 Added TRANSFILE option to the config-parser
TRANSFILE option provides a filename containing transformation
matrices for all ions of a projected shell.
The parser simply reads the numbers into a 2d-array which is left
for interpretation at a later stage.
2015-11-11 11:36:09 +01:00
..
examples/simple Reshuffled files after repository merge 2015-10-13 11:27:55 +02:00
test Added a format check for EIGENVAL to vaspio.py 2015-10-16 11:59:02 +02:00
.gitignore Added density and overlap matrix output ot ElStruct 2015-10-16 16:27:49 +02:00
elstruct.py Fixed a bug in 'debug_density_matrix()' 2015-11-10 12:07:13 +01:00
inpconf.py Added TRANSFILE option to the config-parser 2015-11-11 11:36:09 +01:00
main.py Added density and overlap matrix output ot ElStruct 2015-10-16 16:27:49 +02:00
plotools.py Added DOSMESH option to section [General] 2015-11-10 16:40:46 +01:00
vaspio.py Added orbital labels to 'proj_params' 2015-11-10 15:32:15 +01:00