12 Commits

Author	SHA1	Message	Date
Abdallah Ammar	bb337206eb	refactoring in Davidson	2024-09-10 10:13:50 +02:00
Abdallah Ammar	178cf40214	added Davidson for ppLR_RG0T0pp	2024-09-07 13:59:15 +02:00
Abdallah Ammar	a4eb01b589	introduce nBas_MOs in RHF_search	2024-08-28 19:22:06 +02:00
Abdallah Ammar	992e3dff4b	optim in AdAt	2024-08-21 13:51:12 +02:00
pfloos	04c70f18d8	minimal changes in many files	2023-12-03 18:47:30 +01:00
pfloos	068d88aa06	modifs print qsGW	2023-11-09 09:37:21 +01:00
Pierre-Francois Loos	9fcd61c62e	exp rot in UHF search as well	2023-11-07 16:47:34 +01:00
Pierre-Francois Loos	b794290c96	fix bug in GHF search	2023-11-07 16:11:01 +01:00
Pierre-Francois Loos	66f6890082	routines for exponential of matrices	2023-11-07 10:25:52 +01:00
Pierre-Francois Loos	a2c38aa03b	remove COHSEX and modify phLR in GW routines	2023-07-18 14:59:18 +02:00
Antoine Marie	535b6e2aa2	modif in utils	2023-03-14 14:12:43 +01:00
Pierre-Francois Loos	ca3a985d50	create utils	2019-03-20 13:38:42 +01:00