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Commit Graph

13 Commits

Author SHA1 Message Date
Emmanuel Giner
eaa0764f55 added one_e_dm_ao 2021-09-20 14:04:09 +02:00
c413f07691 Minor changes 2020-12-15 23:46:19 +01:00
08089a4dad Introduced screening.irp.f 2020-05-12 18:48:51 +02:00
15ab29206c Fixed type conversions 2019-12-03 00:15:01 +01:00
eb3a8a679c Working on periodic 2019-12-02 19:25:35 +01:00
Pierre Loos
5e732b0f61 modified stuffs 2019-05-23 16:06:37 +02:00
Emmanuel Giner LCT
35cdb13bd4 added some stuffs for getting the bielec integrals 2019-05-20 08:54:39 +02:00
Emmanuel Giner LCT
a7c1a04840 added get integral ao with two index only 2019-05-16 12:18:43 +02:00
9f7b159fe1 Merge branch 'dev-lct' into dev-lcpq 2019-05-15 16:17:26 +02:00
1a9698301d Removed test in reverse 2019-04-10 18:55:01 +02:00
178a8f5760 Commented index_reverse and acceleration 2019-04-10 17:19:44 +02:00
Emmanuel Giner
1228effa85 minor modifs 2019-04-08 16:15:13 +02:00
24d9745056 Initial commit 2019-01-25 11:39:31 +01:00