6 Commits

Author	SHA1	Message	Date
Anthony Scemama	d4d4393956	cas_ful -> cas_full	2023-11-11 16:13:23 +01:00
Anthony Scemama	c413f07691	Minor changes	2020-12-15 23:46:19 +01:00
Anthony Scemama	77ca529072	Perturbation type	2020-03-06 18:12:04 +01:00
Emmanuel Giner LCT	9ba571a910	removed generators bitmaks, and casscf with not continuous orbital windows is working	2019-10-24 19:02:42 +02:00
Anthony Scemama	cebc19a601	Merge Master (#69) ... * Changed native into SSE4.2 in gfortran.cfg * Fixed rm opam_installer * Fix configure * Improving scaling of pt2 with network * Router/dealer in qp_tunnel * Reduced size of qp2.png * Exclude temp files in tar * Introduce NO_CACHE in configure for daily test * Faster determinants in OCaml * We always give max 10k dets in qp_edit. Read-only if more * Fixed save_natorb * Fixing bug in qp_edit * Comments * Biblio (#61) * Biblio (#62) * Update biblio * Update paper * Journal missing in research.bib * Added paper * Fixed Pierre Francois * Checking number of electrons in MOs * Biblio (#64) * Update biblio * Update paper * Journal missing in research.bib * Added paper * Fixed Pierre Francois * 2 papers * Fixed 6-31G and quickstart (#65) * Fixed 6-31 basis sets * Bug in quickstart * Biblio (#66) * Bugfix (#67) * Fixing opam installation * Fixed 6-31 basis sets * Bug in quickstart * Use irpf90 v1.7.6 * Fix IRPF90 Path	2019-10-21 16:45:00 +02:00
Anthony Scemama	24d9745056	Initial commit	2019-01-25 11:39:31 +01:00