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https://github.com/triqs/dft_tools
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af8cde628e
* 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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.. | ||
plovasp | ||
__init__.py | ||
converter_tools.py | ||
hk.py | ||
vasp.py | ||
wannier90.py | ||
wien2k.py |