10 Commits

Author	SHA1	Message	Date
Abdallah Ammar	674635c057	remove double counting of nuclear repulsion	2024-08-27 15:23:42 +02:00
eginer	31028f8979	fixed some weird dependencies in TC, introduced an AO cholesky 2e function	2024-07-16 17:44:48 +02:00
eginer	42fdb3c435	it works with new routines for pt2 tc	2024-05-07 21:00:19 +02:00
eginer	687259c25f	working on the matrix elements both	2024-05-07 20:32:48 +02:00
eginer	366afb2933	compiling after some cleaning	2024-05-06 18:58:12 +02:00
eginer	109a956f0d	does not compile but working on it	2024-05-06 18:30:05 +02:00
Abdallah Ammar	bd8d45b99b	FIXED BUG IN OPTIM J_BH	2024-05-02 17:18:45 +02:00
Abdallah Ammar	d43d960b1a	TC-SCF CLEANED	2024-05-01 23:10:18 +02:00
eginer	40ea886cf1	added NEED in local/slater_tc	2024-05-01 19:00:02 +02:00
eginer	f35bc23036	Begining to make some cleaning in TC	2024-04-25 19:48:17 +02:00