10
0
mirror of https://github.com/LCPQ/quantum_package synced 2024-12-23 21:03:56 +01:00
Commit Graph

25 Commits

Author SHA1 Message Date
98f3692f4c Merged scemama-master 2017-04-20 19:18:16 +02:00
Anthony Scemama
a2750bb55c Revert "merge with main branch" 2017-04-20 08:48:06 +02:00
Emmanuel Giner
65a7de3182 minor modifs
mend
2017-03-27 15:29:19 +02:00
Emmanuel Giner
6e91ca9104 minor modifs
mend
2017-03-27 15:28:20 +02:00
Emmanuel Giner
c289a410f7 merged toto 2017-03-27 15:15:46 +02:00
Emmanuel Giner
f188250b24 merged files 2017-03-20 16:34:57 +01:00
Emmanuel Giner
de209b3fa8 pouet 2017-02-03 11:51:22 +01:00
097083db47 Repaired selection 2017-01-30 09:38:04 +01:00
3979677a82 MRSC2 no amplitudes 2017-01-11 15:04:00 +01:00
TApplencourt
25b360a409 Update documetation... 2016-11-01 17:07:55 -05:00
9fe84ab137 Add read_wf to overwrite_with_cas 2016-10-11 09:44:28 +02:00
8a87b924f9 Merge branch 'LCPQ-master'
Conflicts:
	src/Integrals_Monoelec/pot_mo_ints.irp.f
2016-09-22 12:19:43 +02:00
dd60cda0ee --amend 2016-09-22 12:15:20 +02:00
98059e87f5 Extracting davidson from slater rules 2016-09-20 17:29:02 +02:00
1354ab86fb Optim MRCC + davidson 2016-05-02 17:06:18 +02:00
ac58cfd0ce Forgot files 2016-04-11 10:48:36 +02:00
0821e76995 Extract CAS 2016-04-11 10:39:27 +02:00
dd8647d5aa Introduced provider for psi_ref_coef_normalized 2016-04-01 01:32:23 +02:00
1ae3e9b5f4 Official Lambda_MRCC 2016-03-31 16:48:23 +02:00
5470e05913 Added target_pt2_qmc 2015-10-19 17:28:08 +02:00
dc3cfb9dbd English 2015-10-06 15:33:11 +02:00
f52e877f7c CISD save energy 2015-09-11 15:30:44 +02:00
2d493fe9c0 MRCC Manu 2015-09-08 15:29:05 +02:00
01699dd0c1 i_H_j_phase_out missing in previous commit 2015-07-28 18:57:43 +02:00
05124ab5d4 Cleaned MRCC in MRCC_Utils 2015-07-13 18:00:38 +02:00