LCPQ/quantum_package
10
0
Fork 0
mirror of https://github.com/LCPQ/quantum_package synced 2024-12-23 04:43:50 +01:00
Code Issues Releases Wiki Activity
2,015 Commits 6 Branches 5 Tags 93 MiB
7fb1132b86
Commit Graph

2015 Commits

This Branch
This Branch
All Branches
Author SHA1 Message Date
Emmanuel Giner
7fb1132b86 strange things in MRPT 2017-03-24 22:49:59 +01:00
Emmanuel Giner
3c9c51ad12 merged 2017-03-24 22:32:52 +01:00
Emmanuel Giner
89ae9650aa minor changes 2017-03-24 22:31:06 +01:00
Emmanuel Giner
11172c8439 Minor changes 2017-03-20 17:27:23 +01:00
Emmanuel Giner
2c6cbbc30b Merge branch 'LCPQ-master' 2017-03-20 16:35:23 +01:00
Emmanuel Giner
f188250b24 merged files 2017-03-20 16:34:57 +01:00
Emmanuel Giner
5ec072ea2d med 2017-03-20 16:21:41 +01:00
Emmanuel Giner
3b8239976a minor modifs in FOBOCI 2017-03-20 16:21:00 +01:00
Emmanuel Giner
cf55bf8093 Merge branch 'master' of https://github.com/eginer/quantum_package 2017-03-17 16:23:03 +01:00
Emmanuel Giner
3426fdc10a minor changes 2017-03-17 16:20:37 +01:00
Emmanuel Giner
d93d28360f added track_orb.irp.f 2017-03-17 16:17:34 +01:00
Emmanuel Giner
65fb9bce6e Merge branch 'master' of https://github.com/eginer/quantum_package 2017-03-17 11:50:43 +01:00
Emmanuel Giner
dd981ed4e9 Merge branch 'master' of https://github.com/eginer/quantum_package 2017-03-17 11:47:11 +01:00
Emmanuel Giner
e8e7985429 minor changes in plugins/FOBOCI/SC2_1h1p.irp.f 2017-03-17 11:46:43 +01:00
Emmanuel Giner
ffb8338487 added density.irp.f 2017-03-17 11:45:35 +01:00
Emmanuel Giner
c5cc7e4d47 New version of FOBOCI 2017-03-17 11:40:48 +01:00
Emmanuel Giner
8885297493 Added SCF_density 2017-03-16 21:21:45 +01:00
Emmanuel Giner
a72b890b92 debugging FOBOCI 2017-03-16 21:21:27 +01:00
Emmanuel Giner
4e0c71df10 density based mrpt2 2017-02-06 21:28:01 +01:00
Emmanuel Giner
de209b3fa8 pouet 2017-02-03 11:51:22 +01:00
Anthony Scemama
4a552cc8fe Merge pull request #182 from TApplencourt/master 
Support new irp
 2017-02-01 21:01:13 +01:00
Thomas Applencourt
693efab41c Update configure 2017-01-31 17:09:56 -06:00
Thomas Applencourt
71c7f2619a Missing PROVIDE 2017-01-31 16:18:48 -06:00
Thomas Applencourt
78c47519da Missing PROVIDE 2017-01-31 16:07:41 -06:00
Thomas Applencourt
c204a890de Missing PROVIDE 2017-01-31 16:01:06 -06:00
Thomas Applencourt
22afa1ea56 Missing PROVIDE 2017-01-31 15:55:28 -06:00
Thomas Applencourt
8c1569df31 Update configure 2017-01-31 14:16:38 -06:00
Thomas Applencourt
b725005c43 Remove irpf90.make in dependency 2017-01-26 07:59:28 -06:00
Thomas Applencourt
f7bf046c39 TApplencourt IRPF90 -> LCPQ 2017-01-26 07:56:16 -06:00
Thomas Applencourt
f850e2ff2b Update dressing.irp.f 2017-01-25 20:23:45 -06:00
Thomas Applencourt
1f42b7092a Update selection.irp.f 2017-01-25 20:19:34 -06:00
Thomas Applencourt
191df237d7 Update selection.irp.f 2017-01-25 20:14:11 -06:00
Thomas Applencourt
885ae02458 Update sort.irp.f 2017-01-25 20:06:48 -06:00
Thomas Applencourt
933efb26f6 Update sort.irp.f 2017-01-25 19:58:10 -06:00
Thomas Applencourt
803b48cc64 Merge pull request #2 from LCPQ/master 
Merge
 2017-01-19 16:54:41 -06:00
Thomas Applencourt
1056b8172b Update configure 2017-01-19 16:39:27 -06:00
Thomas Applencourt
3ddebd1892 Update configure 2017-01-19 16:31:46 -06:00
Thomas Applencourt
44ccc24e72 Restaure map_module.f90 2017-01-19 16:29:50 -06:00
Thomas Applencourt
64f0869486 Merge pull request #1 from LCPQ/master 
Merge...
 2017-01-19 16:10:58 -06:00
Thomas Applencourt
6185049a20 Merge branch 'master' into master 2017-01-19 16:10:32 -06:00
Thomas Applencourt
6d37f3202d Update map_module.f90 2017-01-19 16:06:54 -06:00
Thomas Applencourt
06413b9b59 Update pot_ao_pseudo_ints.irp.f 2017-01-19 16:05:15 -06:00
Thomas Applencourt
f69d458ab6 Update module_handler.py 2017-01-19 16:03:57 -06:00
Thomas Applencourt
9d66d26b8d Delete ifort_knl.cfg 2017-01-19 16:01:38 -06:00
Thomas Applencourt
6db3da733f Fix 404: Update Zlib Url. 2017-01-17 16:05:18 -06:00
Anthony Scemama
bdd71bcaff Merge pull request #179 from barrymoo/allow_non-default_opamroot 
Allow for non-default OPAMROOT locations
 2017-01-04 09:53:42 +01:00
Thomas Applencourt
66dea5e7b8 Corrected OPAM_PATH 2017-01-03 19:29:09 -06:00
Barry Moore
092992aa49 Minimize code addition 2017-01-03 19:39:31 -05:00
Thomas Applencourt
230c07f0f7 Merge pull request #178 from barrymoo/minor_zlib_upgrade 
Minor fix to zlib download
 2017-01-03 17:50:00 -06:00
Barry Moore
ddf798119f Allow for non-default OPAMROOT locations 2017-01-03 18:47:21 -05:00