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mirror of https://github.com/LCPQ/quantum_package synced 2024-06-17 02:35:26 +02:00
Commit Graph

56 Commits

Author SHA1 Message Date
98f3692f4c Merged scemama-master 2017-04-20 19:18:16 +02:00
20f2fff7b2 Merge scemama 2017-04-20 18:04:51 +02:00
Anthony Scemama
a2750bb55c Revert "merge with main branch" 2017-04-20 08:48:06 +02:00
a9414b4a64 Better load balancing in Davidson 2017-04-19 20:46:09 +02:00
9957279967 Better load balancing in Davidson 2017-04-19 20:22:37 +02:00
a28a9d7d33 Better load balancing in Davidson 2017-04-19 20:00:00 +02:00
cbf8c54d70 Parallelization of Davidson 2017-04-19 19:45:18 +02:00
27d07d7676 Fixed distributed Davdison 2017-04-19 16:44:34 +02:00
48f51a71ce Fixed Davidson 2017-04-19 12:24:09 +02:00
dd59338083 Working on davidson 2017-04-19 12:08:37 +02:00
0af043390c Tuned davidson 2017-04-18 18:55:51 +02:00
b4aef21b50 Tuned davidson 2017-04-18 18:41:07 +02:00
df95c1af1c Corrected memory leak in Davidson 2017-04-18 18:22:47 +02:00
6d3a801d0e Parallelization of Davidson 2017-04-18 16:46:08 +02:00
04e9918b90 Davidson ZMQ OK 2017-04-17 01:36:16 +02:00
f8da3159f0 Merge branch 'master' of github.com:scemama/quantum_package 2017-03-25 11:57:12 +01:00
3d21999c7e ZMQ checks 2017-03-25 11:57:06 +01:00
1ae57b97f8 Temporary fix for parallel davdison 2017-03-25 11:56:08 +01:00
317ca2fbaa Fixed Distributed Davidson of a bitch 2017-03-03 12:15:49 +01:00
feb9752ecb Accelerated distributed Davidson 2017-03-01 01:19:17 +01:00
9afc82c878 Less pressure on qp_run when ading tasks 2017-02-28 22:43:59 +01:00
ff05b13259 Update tasks 2017-02-28 14:46:32 +01:00
8b1d083de9 Memory in Davidson 2017-02-27 12:31:41 +01:00
9a7db910d9 Fixed distributed Davidson 2017-02-08 20:54:15 +01:00
1185d70be7 Removed all ipc between Fortran and OCaml 2016-10-18 23:45:44 +02:00
5f83602578 Introduced IPC for qp_run and sub sockets 2016-10-12 12:09:33 +02:00
7fcb4008de Improved parallel davidson 2016-10-11 22:45:40 +02:00
f3a46c55c1 Fixed selection bug 2016-10-11 22:44:51 +02:00
3050eedc1f Comments 2016-10-10 16:38:06 +02:00
cde6fd07e3 merged 2016-10-10 16:03:56 +02:00
Yann Garniron
30eda7b248 removed OMP - double work 2016-10-10 14:45:58 +02:00
Yann Garniron
61f1e0814a better scheduling in davidson_process 2016-10-10 10:13:57 +02:00
f82137ca36 Fixed : Forgot argument in davidson function 2016-10-09 23:25:24 +02:00
4e829fd4b8 Corrected bug 2016-10-09 23:00:14 +02:00
126ae40305 Reduced memory 2016-10-09 22:51:40 +02:00
Yann Garniron
b167dcebef reduced synchronization in davidson_process 2016-10-09 15:03:56 +02:00
de4cf9e3e1 Removed OpenMP in davidson 2016-10-09 00:11:50 +02:00
12407798c9 Merge branch 'garniron-master': Davidson OpenMP
Conflicts:
	src/Davidson/davidson_parallel.irp.f
	src/Davidson/u0Hu0.irp.f
2016-10-08 21:42:43 +02:00
Yann Garniron
c3dd90e199 davidson locally reduces task results 2016-10-08 19:21:53 +02:00
Yann Garniron
e6b528fe03 openMP davidson slave 2016-10-08 00:39:55 +02:00
Yann Garniron
77015118d7 beta-beta now distributed in davidson 2016-10-07 14:14:26 +02:00
b75e7dd2c2 Fixed bug of dimensions in davidson 2016-10-07 12:22:43 +02:00
f7a2710f5c Corrected bug in transposed collector 2016-10-07 09:46:59 +02:00
693604d338 Improve parallel davidson 2016-10-07 00:42:03 +02:00
311df93d20 Corrected N_states N_states_diag i parallel davidson 2016-10-06 14:35:43 +02:00
Yann Garniron
e2154fb892 corrected ZMQ bug - removed stack array 2016-10-06 10:54:40 +02:00
Yann Garniron
1afee06817 a davidson task is a range of blocks 2016-10-06 09:54:52 +02:00
Yann Garniron
32e578c261 further microlisting splash_pq and spot_isinwf 2016-10-05 10:10:28 +02:00
Yann Garniron
f46b9ebe87 optimized davidson_process 2016-10-04 15:29:53 +02:00
Yann Garniron
b49085733a bug with fci_zmq with N_states > 1 2016-10-04 11:30:49 +02:00