|
|
8e6603c85a
|
Forgot files
|
2019-01-29 18:28:15 +01:00 |
|
|
|
f4bff28cd1
|
Warnings in documentation
|
2019-01-29 17:09:08 +01:00 |
|
eginer
|
3315d9855d
|
added dft_one_e
|
2019-01-29 16:13:43 +01:00 |
|
eginer
|
dd5a451679
|
corrected the laplacians of aos
|
2019-01-29 16:08:28 +01:00 |
|
|
|
7fc9d2540f
|
Fixing travis
|
2019-01-28 22:01:50 +01:00 |
|
eginer
|
2a98bc5d39
|
fixed laplacian of aos
|
2019-01-28 15:58:44 +01:00 |
|
|
|
c35594edd3
|
Fixing Davidson
|
2019-01-28 13:00:59 +01:00 |
|
|
|
e8c0ba6ca0
|
Merge branch 'develop' of https://github.com/QuantumPackage/qp2 into develop
|
2019-01-28 12:46:28 +01:00 |
|
|
|
0c88a04ec8
|
Tuned pt2_F
|
2019-01-28 12:46:08 +01:00 |
|
|
|
102084fa59
|
Add support for symbolic link which target qpsh
|
2019-01-28 11:32:06 +01:00 |
|
|
|
ef5c0357d7
|
Add support for symbolic link which target qpsh
|
2019-01-28 11:31:29 +01:00 |
|
|
|
89d3f6312d
|
Fixing Davidson
|
2019-01-27 22:43:44 +01:00 |
|
|
|
29ec5aeea3
|
Fixed tests
|
2019-01-27 22:12:25 +01:00 |
|
|
|
dcbce52da1
|
Fixed Davidson
|
2019-01-27 21:58:36 +01:00 |
|
|
|
cd79047f1c
|
Fixing Davidson
|
2019-01-27 19:04:20 +01:00 |
|
|
|
318b1af239
|
Fixing Davidson
|
2019-01-26 19:13:31 +01:00 |
|
|
|
f1e14f0851
|
Fixing Davidson
|
2019-01-26 12:37:25 +01:00 |
|
|
|
da61f60ba4
|
Merge branch 'master' into develop
|
2019-01-26 12:36:44 +01:00 |
|
|
|
63fcb619aa
|
Fixing MPI Davidson
|
2019-01-26 11:29:57 +01:00 |
|
|
|
de1ea90b1e
|
Fixed memory in pt2 slaves
|
2019-01-26 10:56:39 +01:00 |
|
|
|
263b724e1a
|
Fixing large parallel runs
|
2019-01-26 10:34:22 +01:00 |
|
|
|
32d0d5eb1c
|
Fixing qp_export
|
2019-01-26 01:51:22 +01:00 |
|
|
|
2c4aa08edb
|
Fixing qp_export
|
2019-01-26 01:48:32 +01:00 |
|
|
|
2172a8cc3f
|
Fixed qp_export
|
2019-01-26 00:56:59 +01:00 |
|
|
|
aed146282e
|
optimized gfortran configuration
|
2019-01-25 18:59:21 +01:00 |
|
|
|
5329056ef8
|
Merge branch 'develop' of https://github.com/QuantumPackage/qp2
|
2019-01-25 17:13:07 +01:00 |
|
|
|
0992b52dcf
|
Added error messages in davidson slave
|
2019-01-25 17:02:44 +01:00 |
|
|
|
fe86a9b9ed
|
README
|
2019-01-25 16:51:27 +01:00 |
|
|
|
f4efe0009a
|
Added missing gitignore files
|
2019-01-25 16:40:01 +01:00 |
|
|
|
eadc204b92
|
Added external directory
|
2019-01-25 16:39:19 +01:00 |
|
|
|
47d9e216ba
|
Updated links
|
2019-01-25 15:05:44 +01:00 |
|
Anthony Scemama
|
08283385ed
|
Merge pull request #1 from QuantumPackage/develop
First merge to set up read the docs. Still beta version.
|
2019-01-25 15:01:53 +01:00 |
|
|
|
f830999041
|
Included documentation
|
2019-01-25 14:54:38 +01:00 |
|
|
|
24d9745056
|
Initial commit
|
2019-01-25 11:39:31 +01:00 |
|
Anthony Scemama
|
8a453928b2
|
Initial commit
|
2019-01-25 09:32:32 +01:00 |
|
