Oleg Peil 7471691219 Added possibility to specify equivalent groups of ions ...

* Added a new input format for the list of ions. It is now possible
  to group ions (like this [1  2]  [5  6]) that are considered
  equivalent in the solver. This has required changing the internal
  variable 'ion_list' to a dictionary 'ions' which can later be
  enhanced by other features (such as specifying ions by element name).

2018-12-04 12:52:02 -05:00

..

converters

Added possibility to specify equivalent groups of ions

2018-12-04 12:52:02 -05:00

__init__.py

BlockStructure class for manipulating GF structures

2016-09-13 11:57:48 +02:00

.gitignore

Reshuffled some files, added .gitignore

2015-10-21 11:54:22 +02:00

block_structure.py

BlockStructure: fix bug with bool comparison

2018-02-28 14:24:30 +01:00

clear_h5_output.py

Minor clean up, pep-ified to allow doc compilation to run smoothly

2016-05-09 10:19:56 +02:00

CMakeLists.txt

Fixing install of python files after cmake changes

2018-02-14 16:22:11 -05:00

sumk_dft_tools.py

Merge tag '1.5'

2018-05-26 23:56:46 +02:00

sumk_dft.py

Add doc to VASP converter concerning block structure

2018-07-09 10:50:36 -04:00

symmetry.py

Port to new Python interface for Gf

2017-04-06 09:25:17 +02:00

trans_basis.py

Updating import directives, minor correction to commit

2018-05-01 11:55:31 +02:00

update_archive.py

Minor clean up, pep-ified to allow doc compilation to run smoothly

2016-05-09 10:19:56 +02:00

version.py.in

Corrected version.py

2016-06-09 18:11:55 +02:00