20 Commits

Author	SHA1	Message	Date
Abdallah Ammar	8cefe6eb44	save tc coef	2023-05-13 12:18:36 +02:00
eginer	2c1812e5ca	fixed extrpolation energy in fci_tc_bi	2023-05-11 10:42:12 +02:00
Abdallah Ammar	e4664975e1	fixed bug in tc_bi_ortho	2023-04-15 00:59:22 +02:00
Abdallah Ammar	948f839952	print correctly after diag	2023-04-13 13:22:04 +02:00
Abdallah Ammar	b1df3d6d03	save l/r coef after diag	2023-04-13 13:03:10 +02:00
AbdAmmar	31178523fc	Merge pull request #9 from QuantumPackage/dev-stable-tc-scf ... Dev stable tc scf	2023-04-12 23:13:21 +02:00
eginer	e3aadcf06c	last update on davidson S2	2023-04-12 22:44:14 +02:00
AbdAmmar	ecfcc42320	Merge pull request #8 from QuantumPackage/dev-stable-tc-scf ... Dev stable tc scf	2023-04-12 21:36:10 +02:00
eginer	5cfff229a1	fixed bug in S2 for TC davidson	2023-04-12 18:43:44 +02:00
AbdAmmar	1d4df02362	Merge branch 'dev-stable-tc-scf' of https://github.com/QuantumPackage/qp2 into dev-stable-tc-scf ... Conflicts: src/tc_bi_ortho/tc_bi_ortho.irp.f src/tc_bi_ortho/tc_h_eigvectors.irp.f	2023-04-10 20:49:12 +02:00
AbdAmmar	16955745f4	fixed conflict after TC S^2 merge	2023-04-10 20:41:16 +02:00
eginer	367abb3d70	S2 OK in TC	2023-04-10 19:37:54 +02:00
eginer	04715abc64	beginning to work on s2 for TC	2023-04-10 16:12:32 +02:00
AbdAmmar	ad893e4df4	TC-orthog problem: ok	2023-04-03 14:55:02 +02:00
Abdallah Ammar	db7384c18e	few modif for excisted states	2023-03-28 12:02:28 +02:00
eginer	db0c198788	merged with debug-fci-tc	2023-03-16 14:08:57 +01:00
eginer	22fb8c17e2	fixed the bug of misalignement between coefs and determinants in fci_tc_bi_ortho	2023-03-16 14:00:21 +01:00
eginer	d1068047e8	trying to debug some psi_det_generators stuffs in fci_tc_bi	2023-03-15 14:33:10 +01:00
eginer	4e35f9dbf6	does not work	2023-03-15 11:55:03 +01:00
eginer	5bd19df0bc	added tc_bi_ortho	2023-02-07 17:07:49 +01:00