LCPQ/dft_tools
3
0
Fork 0
mirror of https://github.com/triqs/dft_tools synced 2024-12-23 12:55:17 +01:00
Code Issues Releases Wiki Activity
160dc9d9ae
dft_tools/test/python/plovasp/converter
History
Alexander Hampel af8cde628e small adjustments to Vasp converter (closes #146) 
* 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
2020-08-03 12:39:34 +02:00
..
lunio3 synchronize dfttools with app4triqs structure 2020-06-10 17:45:53 +02:00
one_site synchronize dfttools with app4triqs structure 2020-06-10 17:45:53 +02:00
example.cfg synchronize dfttools with app4triqs structure 2020-06-10 17:45:53 +02:00
lunio3.cfg synchronize dfttools with app4triqs structure 2020-06-10 17:45:53 +02:00
lunio3.ref.h5 small adjustments to Vasp converter (closes #146) 2020-08-03 12:39:34 +02:00
mytest.py synchronize dfttools with app4triqs structure 2020-06-10 17:45:53 +02:00
pg_output.ref.h5 small adjustments to Vasp converter (closes #146) 2020-08-03 12:39:34 +02:00
rpath.py synchronize dfttools with app4triqs structure 2020-06-10 17:45:53 +02:00
test_all.py synchronize dfttools with app4triqs structure 2020-06-10 17:45:53 +02:00
test_converter_lunio3.py synchronize dfttools with app4triqs structure 2020-06-10 17:45:53 +02:00
test_converter_one_site.py synchronize dfttools with app4triqs structure 2020-06-10 17:45:53 +02:00