16 Commits

Author	SHA1	Message	Date
eginer	49acd2e2bf	merged with Abdallah	2022-09-30 15:27:43 +02:00
eginer	8788e46049	added test in dav_non_hermit dav	2022-09-26 11:41:55 +02:00
Abdallah Ammar	d919d6ce7d	forked v	2022-07-05 01:17:43 +02:00
eginer	a407d7e156	added test_ueg_self_contained.irp.f	2022-06-17 15:04:32 +02:00
eginer	e99e976c22	added pbe_ueg_self_contained.irp.f	2022-06-15 19:39:01 +02:00
Emmanuel Giner	cbb8d4aa6d	added the possibility to have a pure active space interaction	2021-09-13 14:38:00 +02:00
bpradines	d6d8b0586c	added basis_correction/print_su_pbe_ot.irp.f	2021-02-26 10:18:42 +01:00
bpradines	e5da77577f	removed stupid dependency on the AO integrals in basis_correction	2021-01-14 11:05:03 +01:00
Emmanuel Giner	aa0c44959c	removed stupid dependency in basis_set_correction	2020-11-09 18:30:10 +01:00
Emmanuel Giner	ee267e27e9	minor modifs	2020-09-21 15:38:26 +02:00
Emmanuel Giner LCT	346ea702c4	minor modifs on basis correction	2020-05-19 11:46:29 +02:00
Emmanuel Giner	bef6175ee4	minor modifs	2020-04-15 17:00:15 +02:00
Emmanuel Giner	e061ab18d9	added some functions in on_top_from_ueg.irp.f	2020-04-14 17:45:01 +02:00
Emmanuel Giner	316bc009c1	renaming done for dft	2020-04-07 12:25:00 +02:00
Emmanuel Giner	2fc294cd56	properly added basis_correction	2020-04-07 11:03:19 +02:00
Emmanuel Giner	c4ded9dcfb	added basis correction and test	2020-04-06 15:06:16 +02:00