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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-12-22 11:33:29 +01:00
Commit Graph

398 Commits

Author SHA1 Message Date
0f2e28f773 Published 2019-10-17 23:39:23 +02:00
0444c8daae Merge branch 'master' into biblio 2019-10-17 23:38:21 +02:00
2d61610022
Biblio (#64)
* Update biblio

* Update paper

* Journal missing in research.bib

* Added paper

* Fixed Pierre Francois

* 2 papers
2019-09-10 16:49:08 +02:00
ca5c0b573b Merge branch 'biblio' of github.com:QuantumPackage/qp2 into biblio 2019-09-10 16:48:29 +02:00
a4b8ab668e 2 papers 2019-09-10 16:47:50 +02:00
0c81adfd51 Merge branch 'master' into biblio 2019-09-10 16:43:17 +02:00
618d4ca8b3
Merge pull request #63 from QuantumPackage/bugfix
Bugfix
2019-09-02 17:54:23 +02:00
6d9cb6ea05
Merge branch 'master' into bugfix 2019-09-02 17:25:53 +02:00
5efd47339a Checking number of electrons in MOs 2019-09-02 16:03:40 +02:00
2b0f3282f8
Biblio (#62)
* Update biblio

* Update paper

* Journal missing in research.bib

* Added paper

* Fixed Pierre Francois
2019-09-02 10:12:09 +02:00
a68c5e817f
Merge branch 'master' into biblio 2019-09-02 10:11:41 +02:00
74730032ca Fixed Pierre Francois 2019-09-02 10:09:12 +02:00
b0ed52c0b0
Biblio (#61) 2019-08-28 13:05:54 +02:00
bcd44c30c7 Added paper 2019-08-28 13:05:03 +02:00
4a5806a642 Comments 2019-08-26 23:12:31 +02:00
dced248acd Fixing bug in qp_edit 2019-08-23 18:35:45 +02:00
cc2e58448e Fixed save_natorb 2019-08-23 15:52:10 +02:00
d1c0d179dc We always give max 10k dets in qp_edit. Read-only if more 2019-08-22 19:43:34 +02:00
00f7397a47 Faster determinants in OCaml 2019-08-22 01:03:08 +02:00
6ee1e7b49e Merge branch 'dev-lcpq' of github.com:QuantumPackage/qp2 into dev-lcpq 2019-08-21 17:18:03 +02:00
3f34e43418 Merge
* master: (3 commits)
  Optimized qp_edit -n (#60)
  Fix spurious EOF
  ...
2019-08-21 16:39:09 +02:00
44a0c4a833 Merge branch 'master' into dev-lcpq 2019-08-21 16:31:15 +02:00
6148624fe7
Optimized qp_edit -n (#60) 2019-08-21 16:29:23 +02:00
3120017773 Merge branch 'dev-lcpq' of github.com:QuantumPackage/qp2 into dev-lcpq 2019-08-21 14:56:25 +02:00
Thomas Applencourt
8b14e190a9 Fix spurious EOF 2019-08-20 01:12:05 +02:00
3bd85aec2d Merge branch 'master' into dev-lcpq 2019-08-19 20:17:50 +02:00
f4f75509db
Biblio (#58)
* Update biblio

* Update paper

* Journal missing in research.bib
2019-08-19 20:16:33 +02:00
6a091424d1 Journal missing in research.bib 2019-08-19 20:15:18 +02:00
9030a2812c Merge branch 'biblio' of github.com:QuantumPackage/qp2 into biblio 2019-08-19 20:14:40 +02:00
57541e2cfd Merge branch 'master' into biblio 2019-08-19 20:12:13 +02:00
fcade8c8f7
Fixed installation issues with OPAM
* Changed native into SSE4.2 in gfortran.cfg

* Fixed rm opam_installer

* Fixing opam installation

* Introduce NO_CACHE in configure for daily test
2019-08-19 20:11:39 +02:00
cd2b606daa
Biblio (#57)
* Update biblio

* Update paper
2019-08-19 18:57:43 +02:00
709ad99b50
Merge branch 'master' into biblio 2019-08-19 18:57:26 +02:00
6619ecb8ac Update paper 2019-08-19 18:42:51 +02:00
9fcdf9125b Merge branch 'bugfix' into dev-lcpq 2019-08-19 18:40:42 +02:00
02500848d8 Introduce NO_CACHE in configure for daily test 2019-08-19 17:56:00 +02:00
c09c7592e8 Merge branch 'master' into bugfix 2019-08-19 17:55:11 +02:00
b65400c544
Update biblio (#55) 2019-08-19 13:14:01 +02:00
ef27e2c407 Update biblio 2019-08-19 12:27:05 +02:00
a8a43100a5 Exclude temp files in tar 2019-08-02 13:03:14 +02:00
2c0ad8ccc5 Reduced size of qp2.png 2019-08-02 12:41:24 +02:00
1e7f837d2f Router/dealer in qp_tunnel 2019-08-01 12:11:10 +02:00
0950d03f09 Improving scaling of pt2 with network 2019-07-31 20:56:00 +02:00
d0419b4f0a Fix configure 2019-07-31 16:25:23 +02:00
c34808d05c Merge branch 'dev' into dev-lcpq 2019-07-26 12:41:10 +02:00
e498c21268 Merge branch 'master' into dev 2019-07-26 12:40:59 +02:00
faaba29eb7
Fix rm opam_installer.sh (#53)
* Changed native into SSE4.2 in gfortran.cfg

* Fixed rm opam_installer
2019-07-26 12:39:58 +02:00
dedd2b9087 Fixed rm opam_installer 2019-07-26 12:38:34 +02:00
b483783c13 Changed native into SSE4.2 in gfortran.cfg 2019-07-24 13:22:40 +02:00
133a05c683 Merge branch 'dev' into dev-lcpq 2019-07-24 13:18:23 +02:00