TApplencourt
|
ebb3d391bd
|
qp_install_module -> qp_module
|
2015-09-30 13:36:53 +02:00 |
|
TApplencourt
|
5dc7810bde
|
Fix ezfio path and ocaml version
|
2015-09-30 13:19:45 +02:00 |
|
Thomas Applencourt
|
9eae6e0d9c
|
Merge pull request #27 from LCPQ/master
Merging
|
2015-09-30 13:17:43 +02:00 |
|
|
d071a9e395
|
Fixed ninja bug
|
2015-09-08 16:42:50 +02:00 |
|
|
a55b3cb651
|
Merged with Manu MRCC
|
2015-09-08 16:37:46 +02:00 |
|
|
2d493fe9c0
|
MRCC Manu
|
2015-09-08 15:29:05 +02:00 |
|
|
b7fd9bb101
|
threshold in mo_pseudo_grid for QMC
|
2015-07-31 18:53:43 +02:00 |
|
|
24faf493f3
|
Changed psi_svd into psi_bilinear
|
2015-07-30 16:05:28 +02:00 |
|
|
e23dba89ba
|
Accelerated MRCC
|
2015-07-29 18:27:07 +02:00 |
|
|
e0c3507720
|
Amazing acceleration in MRCC
|
2015-07-29 17:36:51 +02:00 |
|
|
f06d8dc257
|
Accelerated get_excitation_degree_vector
|
2015-07-29 16:08:28 +02:00 |
|
|
7ef8ee171d
|
Accelerated get_excitation_degree_vector
|
2015-07-29 15:35:01 +02:00 |
|
|
c042e5af0c
|
openMP in MRCC_new and corected bug
|
2015-07-29 15:16:42 +02:00 |
|
|
ed7d11bf04
|
Fixed Davdison broken in previous commit
|
2015-07-28 19:00:26 +02:00 |
|
|
01699dd0c1
|
i_H_j_phase_out missing in previous commit
|
2015-07-28 18:57:43 +02:00 |
|
|
eb0cc786ef
|
Added needed files for module
|
2015-07-28 18:49:14 +02:00 |
|
|
51ed95ccde
|
t push origin masterMerge branch 'eginer-master'
|
2015-07-28 18:43:48 +02:00 |
|
|
8671e53615
|
Merge branch 'master' of https://github.com/eginer/quantum_package into eginer-master
Conflicts:
plugins/CISD/README.rst
plugins/CISD_SC2_selected/README.rst
plugins/CISD_selected/README.rst
plugins/DDCI_selected/README.rst
plugins/MRCC_CASSD/.gitignore
src/Determinants/davidson.irp.f
src/Determinants/slater_rules.irp.f
src/Ezfio_files/README.rst
|
2015-07-28 18:36:50 +02:00 |
|
Thomas Applencourt
|
5e8a106d85
|
Merge pull request #99 from TApplencourt/master
Fix path error in doc and graphiz dependancy
|
2015-07-28 17:38:35 +02:00 |
|
Thomas Applencourt
|
006c28f4ee
|
Fix error in doc path
|
2015-07-28 17:31:54 +02:00 |
|
Thomas Applencourt
|
1c35435ea6
|
Fixing doc in double
|
2015-07-28 17:18:45 +02:00 |
|
Thomas Applencourt
|
97c0dcf40b
|
Fix qp_install_module
|
2015-07-28 17:02:00 +02:00 |
|
|
7e1dc45418
|
Minor changes
|
2015-07-28 16:58:41 +02:00 |
|
Thomas Applencourt
|
3d702eff52
|
Remove global variable
|
2015-07-28 16:47:29 +02:00 |
|
Thomas Applencourt
|
b97e337f4b
|
Refortorisation of update_readme
|
2015-07-28 16:45:45 +02:00 |
|
Manu
|
608f1fd302
|
MRCC_Utils_new seems to work, but not sure
|
2015-07-28 16:41:02 +02:00 |
|
|
37599336b0
|
Corrected graphviz bug
|
2015-07-28 15:55:13 +02:00 |
|
Thomas Applencourt
|
5e98b8c2ae
|
Beter separation in development mode and production one
|
2015-07-28 10:23:17 +02:00 |
|
Thomas Applencourt
|
d36d9e3177
|
Add beter instruction for readme
|
2015-07-28 10:03:14 +02:00 |
|
Thomas Applencourt
|
a56df23d9a
|
Remove graphiz dependancy for testing purpose
|
2015-07-28 09:48:47 +02:00 |
|
Thomas Applencourt
|
e9898c4fa1
|
Merge branch 'develop'
|
2015-07-28 09:48:11 +02:00 |
|
Thomas Applencourt
|
97df8d1922
|
Fix graphiz
|
2015-07-28 09:46:38 +02:00 |
|
|
e39afd6c2c
|
Corrected bug with missing README files
|
2015-07-25 00:26:00 +02:00 |
|
|
ce86b932ca
|
Spelling in comments
|
2015-07-25 00:18:19 +02:00 |
|
Thomas Applencourt
|
b2a546ca74
|
Merge pull request #26 from LCPQ/master
Merging
|
2015-07-24 12:10:55 +02:00 |
|
Anthony Scemama
|
640300ef29
|
Merge pull request #98 from scemama/master
MRCC generalized
|
2015-07-24 12:03:57 +02:00 |
|
|
1ff6d37952
|
Merge branch 'LCPQ-master'
|
2015-07-24 11:49:04 +02:00 |
|
|
c6e67d0df7
|
Merge OK
|
2015-07-24 11:48:56 +02:00 |
|
|
95cf564898
|
Lowercase in ocaml
|
2015-07-24 11:23:54 +02:00 |
|
Thomas Applencourt
|
e4d2eda17f
|
Add python
|
2015-07-21 10:11:12 +02:00 |
|
Manu
|
83c8b0c3f8
|
Merge branch 'master' of github.com:eginer/quantum_package
|
2015-07-20 14:39:58 +02:00 |
|
Manu
|
3e3c0567e1
|
MRCC is ok with selected excitation operators
|
2015-07-20 14:19:11 +02:00 |
|
Manu
|
3d64bcd83a
|
fixed bug in dressed_matrix
|
2015-07-20 13:35:38 +02:00 |
|
Thomas Applencourt
|
e712cb410e
|
Merge pull request #97 from TApplencourt/master
Add bulddir variable in ninja
|
2015-07-16 17:54:17 +02:00 |
|
Thomas Applencourt
|
ce22e1a875
|
Merge branch 'master' into develop
|
2015-07-16 17:48:13 +02:00 |
|
Thomas Applencourt
|
997d0aebbd
|
Beter message when installing
|
2015-07-16 17:45:42 +02:00 |
|
Thomas Applencourt
|
b8152bb47a
|
Add builddir for more amazingness
|
2015-07-16 17:36:38 +02:00 |
|
Thomas Applencourt
|
3f84e59f06
|
Merge pull request #96 from TApplencourt/master
Correction of install Bug
|
2015-07-16 16:44:54 +02:00 |
|
Thomas Applencourt
|
f49fea0620
|
Merge branch 'develop'
|
2015-07-16 15:50:37 +02:00 |
|
Thomas Applencourt
|
582c608b3e
|
REMOVE EZFIO_FILE/REAMD.rst
|
2015-07-16 15:50:26 +02:00 |
|