23 Commits

Author	SHA1	Message	Date
Alexander Hampel	a1209f8a53	renamed converters from app_converter.py to app.py ... * adapted all occurences of the converter script file names including the doc files * fixed one failing test: Py_basis_transformation.py	2020-06-23 11:13:00 +02:00
Alexander Hampel	f27399758e	Merge branch 'unstable' into py3 ... merged unstable into py3 * include the major changes of a94f8ed942 of blockstructure.py * adapted all code to python 3 * fixed all tests	2020-06-23 10:53:52 +02:00
Nils Wentzell	97c5cad66e	[py3] Run port_to_triqs3 script	2020-05-27 11:30:24 -04:00
Markus Aichhorn	a94f8ed942	Merge pull request #138 from TRIQS/BSrotations ... BlockStructure and rotations	2020-05-13 12:17:15 +02:00
aichhorn	0ce04d34a7	finished SOC tutorial	2020-05-05 10:29:13 +02:00
aichhorn	4b09b97ce4	Included block_structure.convert_operator() in doc and non-SOC tutorial	2020-04-30 12:47:03 +02:00
aichhorn	85d4664d96	started SOC tutorial	2020-04-27 16:22:11 +02:00
Nils Wentzell	961215ccac	Adjust to nda/h5 changes in triqs pytriqs.archive -> h5 ... -pytriqs.archive.hdf_archive_schemes -> h5.formats	2020-04-08 17:41:18 -04:00
Nils Wentzell	97d4e0b402	[py3] Run 2to3 -w -n **/*.py **/*.py.in	2020-04-08 16:13:42 -04:00
aichhorn	c1fdfd1d8f	Added Tutorial fro basis rotations: Sr2MgOsO6 w/o SOC	2020-04-07 20:50:37 +02:00
aichhorn	5f2782980e	worked on the sr2mgoso6 tutorial	2020-03-31 09:43:05 +02:00
aichhorn	d6977d8bee	cleaned up files in Sr2MgOsO6 doc	2020-03-30 15:55:02 +02:00
aichhorn	a77844ea1a	First draft of the Sr2MgOsO6 w/o SOC doc	2020-03-30 15:46:54 +02:00
aichhorn	b647762349	Merge branch 'merge_vasp2dmft' into unstable	2020-02-17 15:19:58 +01:00
Malte Schüler	7a6450b6fa	implemented multiple ncsf VASP cycles	2019-09-16 10:59:46 +02:00
Manuel	2d491050cc	[doc] Make doc around .indmftpr clear (issue #122)	2019-08-26 13:19:14 -04:00
Malte Schüler	d61b55f0a4	uncompleted work on csc NiO tutorial	2019-07-19 13:33:11 +02:00
Malte Schüler	8f184fc963	tests for plovasp's H(k) and complement. Further work on NiO tutorial	2019-07-12 16:04:10 +02:00
Malte Schüler	a882ffa575	work in NiO tutorial	2019-07-08 09:55:22 +02:00
Manuel	4bbbcf93f1	[doc] Clean and merge python example scripts	2018-12-13 14:23:00 -05:00
Manuel	a8c7569830	change del to with when reading hdf	2018-12-06 17:28:49 -05:00
aichhorn	10018c6aa6	first version of the SrVO3 tutorial / Wien2k version	2018-12-04 12:54:29 -05:00
aichhorn	9cf4521fec	new structure for doc	2018-12-04 12:54:29 -05:00