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Commit Graph

20 Commits

Author SHA1 Message Date
Emmanuel Giner
15c15a65f7 merge with Toto 2019-01-04 16:42:55 +01:00
Emmanuel Giner
d924386eed added qp_e_conv_fci and print_e_conv.irp.f 2019-01-04 02:17:55 +01:00
9541e7ac4a Documentation 2019-01-04 02:10:02 +01:00
e46ea31b96 Tests OK for CISD 2019-01-04 00:03:58 +01:00
Anthony Scemama
d1c324d8f3
Toto (#85)
* minor changes in README.rst of many src files

* added ROHF_b2.gms.out

* modified some scripts

* modified README.rst

* modifs in docs/intro

* added qp_e_conv_fci

* changed the doc

* added some README.rst

* modifs in docs

* introduced the sgn grids

* added 21.rsks.bats

* added EZFIO.cfg
2019-01-03 14:52:58 +01:00
Emmanuel Giner
84f02fa118 merged with toto 2019-01-03 12:57:54 +01:00
a9191d23b2 Documentation 2019-01-02 23:04:13 +01:00
Anthony Scemama
c7894e3419
Toto (#84)
* minor changes in README.rst of many src files

* added ROHF_b2.gms.out

* modified some scripts

* modified README.rst

* modifs in docs/intro

* added qp_e_conv_fci

* changed the doc

* added some README.rst

* modifs in docs

* introduced the sgn grids

* added 21.rsks.bats
2019-01-02 21:48:54 +01:00
Emmanuel Giner
75ca9b2160 added 21.rsks.bats 2019-01-02 16:10:15 +01:00
Emmanuel Giner
6d808df0a0 changed the doc 2018-12-29 16:04:53 +01:00
Emmanuel Giner
814613fe7b added qp_e_conv_fci 2018-12-29 15:24:35 +01:00
123de0381e Added modules 2018-12-28 19:50:28 +01:00
Emmanuel Giner
062020ffdc Toto (#83)
* minor changes in README.rst of many src files

* added ROHF_b2.gms.out

* modified some scripts

* modified README.rst

* modifs in docs/intro
2018-12-28 19:41:11 +01:00
Emmanuel Giner
606d20dc0f modifs in docs/intro 2018-12-28 19:38:49 +01:00
d292f00154 gitignore files 2018-12-25 19:24:43 +01:00
ed74e3a519 Documentation 2018-12-25 19:11:56 +01:00
0ba3fdd7a2 Documentation 2018-12-25 18:59:11 +01:00
a4f11b12fe Updated documentation 2018-12-21 00:13:41 +01:00
4b21b8cd0e Fixed tests 2018-12-18 17:30:16 +01:00
2929828ae3 Working on doc 2018-11-26 13:45:32 +01:00