13 Commits

Author	SHA1	Message	Date
eginer	a38bf00975	updated default keywords in tc_keywords and ao_twoe_e_ints	2024-05-08 17:26:48 +02:00
eginer	18fd70f1b8	added get_d1_transp.irp.f	2024-05-07 20:18:24 +02:00
eginer	b7787f5e6d	trying to speed up the PT2 in TC by transposing the array of tc integrals	2024-05-07 19:43:05 +02:00
eginer	17ae4d8fe2	added tc_progs	2024-05-07 18:27:09 +02:00
eginer	64523de3ae	minor modifs in cipsi_tc_bi_ortho/selection.irp.f	2024-03-22 18:33:17 +01:00
Anthony Scemama	f3a3c3ee63	Merge branch 'master' into dev-stable	2024-03-20 15:03:37 +01:00
Kevin Gasperich	65d7ca1aa2	Merge branch 'master' into ormas-clean	2024-03-19 11:08:38 -05:00
eginer	28912ce5ca	Merge branch 'dev-stable' of https://github.com/QuantumPackage/qp2 into dev-stable	2024-03-12 17:38:38 +01:00
Anthony Scemama	0618372b29	Commented out select_singles in TC	2024-03-12 17:38:30 +01:00
eginer	fee83210a7	Merge branch 'dev-stable' of https://github.com/QuantumPackage/qp2 into dev-stable	2024-03-12 17:29:44 +01:00
Anthony Scemama	f816773102	Refactor CIPSI / TC-CIPSI	2024-03-12 17:27:43 +01:00
eginer	9175fb21c9	modifs in json and diagonalize_ci for fci tc bi	2024-03-12 14:05:38 +01:00
Anthony Scemama	b95c8142a5	Moved many modules in plugins/local for quicker installation	2023-11-07 10:27:34 +01:00