Oleg E. Peil 4cc989fbea Fixed class ElectronicStructure ...

Small fixes to accord with the changes of Vaspio:
* 'nspin' is now taken from Eigenval.ispin
* 'nc_flag' is now determined from the value of 'ncdij' read from DOSCAR
* 'ferw' is now taken from Eigenval

2015-10-14 16:22:10 +02:00

..

converters

Moved 'vasp_converter.py' to 'converters'

2015-10-13 11:36:43 +02:00

vasp

Fixed class ElectronicStructure

2015-10-14 16:22:10 +02:00

__init__.py

Moved U_matrix to TRIQS library

2015-06-17 18:19:30 +02:00

clear_h5_output.py

Fix subgroup name in clear_h5_output.py

2015-03-12 11:01:02 +01:00

CMakeLists.txt

Clean CMakeLists.txt

2013-08-07 16:30:09 +02:00

sumk_dft_tools.py

Removes work around for issue #41

2015-08-10 16:14:51 +02:00

sumk_dft.py

Removes work around for issue #41

2015-08-10 16:14:51 +02:00

symmetry.py

Removes work around for issue #41

2015-08-10 16:14:51 +02:00

trans_basis.py

[doc] New documentation

2015-04-21 14:31:15 +02:00

update_archive.py

Unify notation in sumk_dft_tools.

2015-01-22 10:47:53 +01:00