|
|
d72c1884a1
|
Monte Carlo runs in parallel
|
2018-10-13 11:48:46 +02:00 |
|
|
|
a016472d46
|
MonteCarlo in parallel
|
2018-10-13 00:17:45 +02:00 |
|
|
|
74858cb943
|
Added initiator tasks
|
2018-10-12 12:15:37 +02:00 |
|
|
|
d717a9c138
|
Update alpha factory
|
2018-10-12 11:58:48 +02:00 |
|
|
|
f08d29d1a9
|
Update alpha factory
|
2018-10-12 11:55:04 +02:00 |
|
|
|
09c0de9054
|
Parallelism and static
|
2018-10-10 10:28:05 +02:00 |
|
|
|
651fabe295
|
Updated shiftedbk slave
|
2018-10-07 20:23:22 +02:00 |
|
|
|
8d5625b55d
|
Merge branch 'master' of https://github.com/scemama/quantum_package
|
2018-10-05 23:05:04 +02:00 |
|
|
|
fadb96856d
|
Retry with zmq_abort
|
2018-10-05 22:44:15 +02:00 |
|
|
|
2a54a2e449
|
Improved sort
|
2018-10-05 10:15:53 +02:00 |
|
|
|
84db0e88ee
|
Added README
|
2018-10-04 16:35:54 +02:00 |
|
|
|
b1473c57c0
|
Fix travis
|
2018-10-04 16:13:16 +02:00 |
|
|
|
71264bb8fe
|
Merge branch 'master' of github.com:scemama/quantum_package
|
2018-10-04 16:12:33 +02:00 |
|
|
|
62f60d049b
|
Merge branch 'master' of github.com:scemama/quantum_package
|
2018-10-04 13:49:40 +02:00 |
|
|
|
40149c7daf
|
Improved parallel scaling of Davidson
|
2018-10-04 13:17:43 +02:00 |
|
|
|
600512300c
|
Improved parallel scaling of Davidson
|
2018-10-04 01:35:24 +02:00 |
|
|
|
152ba01c17
|
Optimized Davidson
|
2018-10-04 00:29:30 +02:00 |
|
|
|
c688c057a8
|
Better scaling of Davidson
|
2018-10-03 22:44:26 +02:00 |
|
|
|
0a075913c1
|
openmp guided
|
2018-10-03 13:43:42 +02:00 |
|
|
|
d3c74ae300
|
Removed extra diagonalization
|
2018-10-02 23:03:44 +02:00 |
|
|
|
d2e3ed360c
|
Pack tasks
|
2018-10-02 22:48:45 +02:00 |
|
|
|
b6bcff1ba2
|
Accelerated selection
|
2018-10-02 21:58:30 +02:00 |
|
|
|
271b004cfb
|
Fixed parallel SBK
|
2018-10-02 14:50:37 +02:00 |
|
|
|
64fd675e3b
|
Merge branch 'master' of github.com:scemama/quantum_package
|
2018-09-30 22:40:46 +02:00 |
|
|
|
4994e096cd
|
Fragments
|
2018-09-30 22:40:34 +02:00 |
|
|
|
189eb27cec
|
Better fragmentation
|
2018-09-30 19:33:48 +02:00 |
|
|
|
554664f8bb
|
Fixed tests
|
2018-09-29 15:00:48 +02:00 |
|
|
|
8e74682fc5
|
changed default PT2 error
|
2018-09-29 01:34:28 +02:00 |
|
|
|
3c6e775291
|
Fixed tests
|
2018-09-29 01:03:25 +02:00 |
|
|
|
4bd3c9e275
|
Fixed MRCC_ZMQ
|
2018-09-29 00:43:31 +02:00 |
|
|
|
6de4260e17
|
MRCC fixed
|
2018-09-29 00:32:17 +02:00 |
|
|
|
db10fcceeb
|
Working on fix for MRCC but maybe broke ShiftedBk.
|
2018-09-28 19:21:55 +02:00 |
|
|
|
26e51230a8
|
Merge branch 'master' of github.com:scemama/quantum_package
|
2018-09-28 09:09:39 +02:00 |
|
|
|
5d6729e927
|
Working on mrcc
|
2018-09-28 09:09:27 +02:00 |
|
|
|
67b300b5dd
|
Merge branch 'thesis' of git://github.com/garniron/quantum_package
|
2018-09-27 14:51:39 +02:00 |
|
Yann Garniron
|
65765b9261
|
to be cleaned - addition mrcc
|
2018-09-27 14:32:41 +02:00 |
|
Yann Garniron
|
1d6de29c46
|
removed debug
|
2018-09-27 12:11:04 +02:00 |
|
Yann Garniron
|
c8d64668d0
|
same as previous but including the files
|
2018-09-27 12:09:05 +02:00 |
|
Yann Garniron
|
e1c84a8b1c
|
thesis-like mrcc
|
2018-09-27 11:38:56 +02:00 |
|
|
|
04d810ed6f
|
Removed unused use
|
2018-09-26 18:40:23 +02:00 |
|
Anthony Scemama
|
f8855e37a1
|
Merge pull request #74 from garniron/thesis
Thesis
|
2018-09-26 18:32:07 +02:00 |
|
Yann Garniron
|
cfc37ea57c
|
Merge github.com:scemama/quantum_package into thesis
Conflicts:
plugins/Full_CI_ZMQ/pt2_stoch_routines.irp.f
plugins/Full_CI_ZMQ/run_pt2_slave.irp.f
plugins/Full_CI_ZMQ/run_selection_slave.irp.f
plugins/Full_CI_ZMQ/selection.irp.f
plugins/Generators_full/generators.irp.f
plugins/dress_zmq/dress_stoch_routines.irp.f
plugins/dress_zmq/dressing.irp.f
plugins/dress_zmq/run_dress_slave.irp.f
plugins/shiftedbk/shifted_bk_routines.irp.f
src/Determinants/slater_rules.irp.f
|
2018-09-26 18:12:49 +02:00 |
|
|
|
d0a5e7d253
|
Removed prints
|
2018-09-26 16:39:57 +02:00 |
|
|
|
118bdba3f9
|
Removed prints
|
2018-09-26 16:15:53 +02:00 |
|
|
|
502fd9d1fd
|
Fixed sBK
|
2018-09-26 15:53:54 +02:00 |
|
|
|
7fc89d857e
|
Type errors
|
2018-09-25 16:08:00 +02:00 |
|
|
|
fb836d063e
|
Bug
|
2018-09-25 12:49:47 +02:00 |
|
|
|
4a48a6b94f
|
Fixed shiftedBk
|
2018-09-25 09:56:12 +02:00 |
|
|
|
2058af1af5
|
Memory control not needed on slaves
|
2018-09-23 22:27:41 +02:00 |
|
|
|
5e19eb4aaa
|
Fixed bug introduced in 98b2384d43
|
2018-09-21 11:13:38 +02:00 |
|
