8 Commits

Author	SHA1	Message	Date
Alexander Hampel	e26444201a	Updated reference documentation for PLOVASP classes and functions.	2019-12-04 12:32:00 -05:00
Malte Schüler	6b11183f4d	fixed tests for incorporating kpts	2019-11-21 21:34:37 +01:00
Malte Schüler	1dd7552529	plovasp: added documentation and tests	2019-06-28 14:47:15 +02:00
Malte Schüler	90de1f3ab6	plovasp: added new input flags. Implemented band selection. Finished implementing corr.	2019-06-27 09:05:04 +02:00
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
Oleg E. Peil	bda2e5e2a3	Added copyright disclaimers to PLOVasp sources	2016-02-01 14:06:41 +01:00
Oleg E. Peil	3620784798	Replaced R- and C-TRANSFORM with TRANSFORM option ... Also, some tests were modified accordingly.	2015-11-30 20:24:34 +01:00
Oleg E. Peil	0d65f38a61	Moved PLOVasp files to converters/plovasp	2015-11-27 10:48:15 +01:00