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mirror of https://github.com/LCPQ/quantum_package synced 2024-06-30 00:44:28 +02:00
Commit Graph

28 Commits

Author SHA1 Message Date
Thomas Applencourt
f628bdee18 Rename MonoInts into Integrals_Monoelec 2015-05-12 11:05:07 +02:00
Thomas Applencourt
1a634b4ed2 Change image name, add image in README.rst, and add Graphviz in dependancy 2015-05-12 10:39:49 +02:00
Thomas Applencourt
5777753d6b Add all.png to git 2015-05-12 10:05:20 +02:00
e438d8582b Removed Output module 2015-05-11 19:41:56 +02:00
0a1ba724aa Fixed bugs 2015-05-06 18:26:36 +02:00
d6ec67e840 Fixed Full CAS-SD 2015-05-06 17:01:45 +02:00
bfddb4f9d9 Added EZFIO.cfg and s2_eig test in diag 2015-05-06 15:05:08 +02:00
Thomas Applencourt
acb6b7b16a Add NEED_CHILDREN_MODULE to replace NEEDED_MODULES 2015-04-30 18:56:04 +02:00
Thomas Applencourt
3b59fca0c7 Add EZFIO.cfg in determinants 2015-04-20 15:20:38 +02:00
Thomas Applencourt
5947026af0 Fix update_README.py 2015-04-13 10:55:48 +02:00
7d7626df53 Cleaning 2015-04-10 19:32:35 +02:00
Thomas Applencourt
0e9f78d51d Merge #2 2015-04-10 18:13:06 +02:00
Thomas Applencourt
6958490a02 Merge 2015-04-10 18:10:03 +02:00
Thomas Applencourt
1abca0aa68 Trying to merge 2015-04-10 18:05:47 +02:00
47d913a9ce Fixed CAS-SD 2015-04-10 17:26:07 +02:00
6ac88cf789 Forgot file 2015-04-10 11:06:33 +02:00
8bb2c8c898 Removed debug in connected_to_ref.irp.f 2015-04-10 00:44:12 +02:00
b5b211aaea MRCC is parallelized 2015-04-09 23:59:06 +02:00
0f2bdedb90 Moves psi_cas in Dets 2015-04-09 22:32:25 +02:00
99e63935d4 MRCC works 2015-04-09 21:46:37 +02:00
102bbb0b4f Lots of minor fixes 2015-04-09 21:46:28 +02:00
dcd9310033 Solved problem with lowercases 2015-04-07 10:50:37 +02:00
fe3c2bb875 Minor changes 2015-04-03 14:26:14 +02:00
Thomas Applencourt
26e41d52a5 Fix conflicts 2015-04-02 15:04:18 +02:00
2204bc4aba Corrected CAS-SD bug 2015-04-02 11:40:16 +02:00
c8c64a76ff Renamed psi_generators in psi_det_generators 2015-04-02 10:26:45 +02:00
a95adca2c7 Working on MRCC 2015-04-02 10:13:33 +02:00
ad75f3fd68 Working on MRCC 2015-04-01 13:23:02 +02:00