9 Commits

Author	SHA1	Message	Date
AbdAmmar	90ff4af1a0	fock(3e) DGEMM	2023-09-02 17:17:55 +02:00
Abdallah Ammar	7d04a650b7	CS & OS of alpha & beta	2023-09-02 16:47:24 +02:00
Abdallah Ammar	e0a11ad21d	alpha part: 1st and 2nd terms of OS	2023-09-01 09:34:54 +02:00
Abdallah Ammar	5ca864b7b0	DGEMM for fock_3e_uhf_mo_cs: OK	2023-08-30 18:49:09 +02:00
AbdAmmar	b39daa53c4	added keywords for r1 grid	2023-07-02 21:49:25 +02:00
eginer	436b881580	added thresh_cycle	2023-03-28 11:21:19 +02:00
Abdallah Ammar	10b461f5a2	tc_scf: combined	2023-03-04 02:10:45 +01:00
eginer	cc16cea1b0	cleaning in tc_scf	2023-02-07 16:45:10 +01:00
eginer	a4bb488d64	tc_scf compiles and gives good energy for Ne. Added a test in test_Ne.sh	2023-02-06 19:26:58 +01:00