the-hampel 511589c0d5 [fix] fixes for latest dfttools version

2025-02-20 12:08:36 +01:00

..

__init__.py

update documentation to use autosummary

2022-03-02 14:13:12 -05:00

.gitignore

synchronize dfttools with app4triqs structure

2020-06-10 17:45:53 +02:00

atm_desc.py

Automated porting to triqs + meshes + nda

2021-05-26 17:59:50 -04:00

converter.py

[doc] fixes for Vasp interface and general doc fix

2023-06-19 17:30:02 -04:00

elstruct.py

new VASP 6.5.0 hdf5 support capability (#262)

2025-01-09 20:44:31 +01:00

inpconf.py

[vasp] change normion default to False

2023-07-24 11:30:39 -04:00

plotools.py

new VASP 6.5.0 hdf5 support capability (#262)

2025-01-09 20:44:31 +01:00

proj_group.py

[doc] fixes for Vasp interface and general doc fix

2023-06-19 17:30:02 -04:00

proj_shell.py

(style) add proper logging for warnings and debug info

2023-03-24 17:43:19 +01:00

sc_dmft.py

[fix] fixes for latest dfttools version

2025-02-20 12:08:36 +01:00

vaspio.py

[fix] volume of tetrahedra is called volt not vtet, and DOS routine expects a long in C, enforce dtype of itet

2025-02-19 11:47:46 +01:00