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mirror of https://github.com/triqs/dft_tools synced 2024-07-04 18:36:05 +02:00
dft_tools/python
Oleg E. Peil 54b9857aa5 Added density and overlap matrix output ot ElStruct
The new method in ElectronicStructure allows one to output
denisty and overlap matrices originating from the raw projectors
read from PROJCAR (LOCPROJ). This output is mainly intended for debug purposes.
2015-10-16 16:27:49 +02:00
..
converters Moved 'vasp_converter.py' to 'converters' 2015-10-13 11:36:43 +02:00
vasp Added density and overlap matrix output ot ElStruct 2015-10-16 16:27:49 +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