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

20 Commits

Author SHA1 Message Date
7f4634e49b Isolated SVD routine 2015-11-27 10:15:46 +01:00
281c6aae33 Added tput after vim 2015-11-27 09:20:28 +01:00
efe8cbe28d Sort gitignore in ocaml 2015-10-17 15:54:29 +02:00
e28de8a15e Merge branch 'master' of https://github.com/garniron/quantum_package into garniron-master
Conflicts:
	ocaml/.gitignore
	plugins/CAS_SD/README.rst
	plugins/Full_CI/README.rst
	plugins/MRCC_Utils/README.rst
	plugins/Perturbation/README.rst
	src/Determinants/README.rst
	src/Ezfio_files/README.rst
2015-10-16 13:55:32 +02:00
Yann Garniron
bbbc72341a minilist primitive/tri par alpha en cours 2015-10-16 13:06:19 +02:00
dc3cfb9dbd English 2015-10-06 15:33:11 +02:00
6476d432be Added EZFIO.cfg for CISD 2015-09-22 09:47:07 +02:00
01699dd0c1 i_H_j_phase_out missing in previous commit 2015-07-28 18:57:43 +02:00
Manu
3e3c0567e1 MRCC is ok with selected excitation operators 2015-07-20 14:19:11 +02:00
72dbdff2c6 Add truncate_wf in Determinants 2015-07-03 14:55:09 +02:00
Thomas Applencourt
93eafd009d Update the EZFIO.cfg with the new keyword 2015-06-18 15:04:44 +02:00
Thomas Applencourt
abbcb3195a Change global variable 2015-06-18 11:11:14 +02:00
96a16cc46e Little changes 2015-06-11 16:25:35 +02:00
0a72c3af4c Minor changes 2015-06-09 11:15:56 +02:00
Thomas Applencourt
985592ad89 Fix ocaml makefile 2015-06-03 13:23:10 +02:00
Thomas Applencourt
8bf723dcfc Mega cleaning. 2015-06-02 18:17:59 +02:00
9676f62674 A lot of cleaning. Removed CIS_dressed. 2015-01-15 14:00:00 +01:00
a4688e7500 Bitmasks OK 2014-09-17 00:39:21 +02:00
19fbdd88c6 Added set_mo_class ocaml script 2014-08-26 15:31:16 +02:00
9bffc0883b Added molecule in ocaml 2014-08-24 20:00:26 +02:00