31 Commits

Author	SHA1	Message	Date
Anthony Scemama	0c190934a8	Format in pseudo	2017-12-01 13:27:34 +01:00
Anthony Scemama	8dd2dcb44f	Reduced memory in 4idx	2017-11-29 09:35:11 +01:00
Anthony Scemama	1a5a4d5ff2	Introduced MPI for EZFIO accesses	2017-11-28 01:05:28 +01:00
Anthony Scemama	12295ce7c0	Removed aligns	2017-11-27 10:58:32 +01:00
Anthony Scemama	8826ba9c2d	Fixed travis	2017-10-30 15:35:55 +01:00
Anthony Scemama	a50663a77a	Working on four_idx_zmq	2017-10-13 21:10:53 +02:00
Anthony Scemama	1c58249f53	Integrated in main program	2017-10-02 11:40:36 +02:00
Anthony Scemama	cb1227a9a9	OK	2017-09-25 20:23:50 +02:00
Anthony Scemama	a28a9d7d33	Better load balancing in Davidson	2017-04-19 20:00:00 +02:00
Anthony Scemama	9ef173e058	Amazing new things	2017-01-18 16:06:23 +01:00
Anthony Scemama	a3e2292b8e	Merge with Dr. Giner	2016-11-02 21:46:12 +01:00
Emmanuel Giner	d13853691a	conflicts minimized for merge	2016-11-02 17:39:39 +01:00
Emmanuel Giner	124d918021	forgotten files	2016-11-02 16:01:01 +01:00
Anthony Scemama	3946c710fe	Accelerated mono-excitations (mipi miip)	2016-10-28 22:37:05 +02:00
Emmanuel Giner	bd91472407	selected integrals is ok	2016-10-12 21:29:15 +02:00
Emmanuel Giner	82a29d5603	no vvv integrals is ok	2016-10-11 19:03:23 +02:00
Anthony Scemama	6e897584e9	Bug in integrals	2016-10-10 17:08:53 +02:00
Anthony Scemama	3050eedc1f	Comments	2016-10-10 16:38:06 +02:00
Emmanuel Giner	a0d5869054	Modifs of fobo-scf	2016-07-16 16:09:50 +02:00
Anthony Scemama	4b56ae9a3f	Merge branch 'LCPQ-master'	2016-07-06 11:30:47 +02:00
Anthony Scemama	ff391db161	mmap seems OK	2016-06-16 12:47:08 +02:00
Anthony Scemama	39366f7ec1	mmap works for integrals	2016-06-14 13:59:05 +02:00
Emmanuel Giner	f030c4b6fe	Merged with LCPQ	2016-03-14 16:12:25 +01:00
Emmanuel Giner	ac8e530372	FOBO-SCF executable works	2016-03-11 23:27:39 +01:00
Anthony Scemama	20a857c446	Distributed PT2	2016-02-19 00:20:28 +01:00
Anthony Scemama	97a966df04	Threshold in MO transformation	2016-01-02 22:04:24 +01:00
Anthony Scemama	6d05c72143	Added CAS-SCF module	2015-11-30 19:36:18 +01:00
Anthony Scemama	d05c851ba6	cleaning	2015-11-25 01:08:31 +01:00
Anthony Scemama	62a8253244	Introduced Schwartz screening in map_get	2015-11-16 22:08:36 +01:00
Anthony Scemama	21f18406b7	Integrals goind from Write to Read	2015-09-22 13:42:23 +02:00
Thomas Applencourt	6d8004e723	Change Bielec_integrals => Integrals_Bielec	2015-05-12 11:30:05 +02:00