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![]() * adding kpts_basis, kpts, and kpt_weights to h5 dft_input * read these properties as optional arguments in Sumk_dft.py * change accordingly the ref h5 files for vasp converter test * soon all converters are demanted to store those properties * bz_weights should then be replaced by kpt_weights * closes PR #146 |
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.. | ||
__init__.py | ||
.gitignore | ||
atm_desc.py | ||
converter.py | ||
elstruct.py | ||
inpconf.py | ||
plotools.py | ||
proj_group.py | ||
proj_shell.py | ||
sc_dmft.py | ||
vaspio.py |