Oleg E. Peil b3e1dd915a Refactored mapping onto block matrix in 'orthogonalize()' ... The implementation of the mapping of a set of projectors (belonging to different shells and ions) onto a block matrix in the orthogonalization routine has been generalized. Now, an implementation of the choice between the full orthogoanlization and per-site one is straightforward: it is just a matter of defining a proper mapping. The mapping scheme itself is described in the doc-string of method 'ProjectorGroup.orthogonalize()'		2015-11-19 11:47:59 +01:00
..
converters	Fixed inequivalent shell determination	2015-11-10 19:16:41 +01:00
vasp	Refactored mapping onto block matrix in 'orthogonalize()'	2015-11-19 11:47:59 +01:00
__init__.py	Moved U_matrix to TRIQS library	2015-06-17 18:19:30 +02:00
.gitignore	Reshuffled some files, added .gitignore	2015-10-21 11:54:22 +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