9 Commits

Author	SHA1	Message	Date
eginer	d9b2298d9a	improved casscf and added README.rst	2023-10-06 15:36:38 +02:00
Anthony Scemama	7afc7e5fa4	OpenMP in MO optimization	2023-08-22 10:49:59 +02:00
eginer	8515fcf93f	updated DOC for correct normalization of two-rdms	2023-02-27 17:48:42 +01:00
eginer	fd63ab1355	state_av_full_occ_2_rdm_aa_mo work	2023-02-27 17:33:43 +01:00
eginer	3ba5d3b540	factor two introduced in non active only non state average two-rdm, it works with example.irp.f	2023-02-27 15:45:09 +01:00
Emmanuel Giner	ca2b58b495	fixed two rdms	2021-06-03 14:57:45 +02:00
Emmanuel Giner	2e90197987	renamed and documented properly all providers for two rdms	2020-03-22 18:09:04 +01:00
Emmanuel Giner	570a710de5	renamed two rdm	2020-03-22 17:21:49 +01:00
Emmanuel Giner	6b282c042c	all 2rdm clean and work with openmp	2020-03-22 17:15:39 +01:00