|
|
fe0e5ae764
|
Merge branch 'master' of github.com:scemama/quantum_package
|
2017-05-24 16:57:47 +02:00 |
|
|
|
19d9706cf0
|
Fixed travis
|
2017-05-24 16:57:04 +02:00 |
|
|
|
20e7a23ef7
|
Fixed pseudos
|
2017-05-24 15:24:51 +02:00 |
|
scemama
|
70d52c126a
|
Larges messages for 100M
|
2017-05-24 15:24:20 +02:00 |
|
scemama
|
f80807b163
|
Use recv8 and snd8 in ZMQ for large wf
|
2017-05-24 00:06:31 +02:00 |
|
|
|
2fd46841ae
|
Fixed selection CASSD slave
|
2017-05-23 19:30:51 +02:00 |
|
|
|
21bcaa0bf1
|
Removed production mode in configure
|
2017-05-23 18:37:41 +02:00 |
|
|
|
0de5cafcc0
|
Fixed selection
|
2017-05-19 14:38:48 +02:00 |
|
|
|
c518bcff0e
|
phasemask is integer*4
|
2017-05-19 14:21:21 +02:00 |
|
|
|
0ae7dfc224
|
Accelerated OCaml Psi messages
|
2017-05-18 18:53:55 +02:00 |
|
|
|
e8f35b59d4
|
Reduced memory (phasemask)
|
2017-05-18 17:54:37 +02:00 |
|
Thomas Applencourt
|
84299807f1
|
Merge pull request #196 from scemama/master
Better parallel scaling
|
2017-05-18 09:34:13 -05:00 |
|
|
|
ce623221cd
|
Reduced stask size
|
2017-05-18 15:05:36 +02:00 |
|
|
|
ea70831a90
|
Fixed assert
|
2017-05-18 14:36:06 +02:00 |
|
|
|
625decb5ed
|
Set HWM to 1 in ZMQ
|
2017-05-18 14:11:22 +02:00 |
|
|
|
5e920a33d1
|
Reduced memory
|
2017-05-18 11:35:01 +02:00 |
|
|
|
ef5f905afc
|
Dissymmetrized u0Hu0: less memory and communication
|
2017-05-18 11:25:00 +02:00 |
|
|
|
ef07f9bc8e
|
Merge branch 'master' of github.com:scemama/quantum_package
|
2017-05-17 22:49:19 +02:00 |
|
|
|
be8c3b3c4c
|
Fixed davidson slave
|
2017-05-17 22:49:15 +02:00 |
|
|
|
b236949b9c
|
Fixed density_matrix
|
2017-05-17 22:48:24 +02:00 |
|
|
|
7855e4c07b
|
Distributed davidson for >100k dets
|
2017-05-17 21:28:34 +02:00 |
|
|
|
ca4ad5687b
|
Parallelized psi_energy
|
2017-05-17 21:23:03 +02:00 |
|
|
|
be733d8f12
|
Fixed Davdison slave
|
2017-05-17 09:23:16 +02:00 |
|
Thomas Applencourt
|
cebf1594af
|
Merge pull request #195 from scemama/master
Fixed u0Hu0
|
2017-05-16 10:15:42 -05:00 |
|
|
|
e1dbd6795d
|
Fixed for new IRPF90
|
2017-05-16 16:58:24 +02:00 |
|
|
|
05df6784da
|
Conditional compiling for ZMQ_PUSH
|
2017-05-16 16:31:35 +02:00 |
|
|
|
ae4d564839
|
Added assert flag for travis
|
2017-05-16 15:54:34 +02:00 |
|
|
|
3d51dde718
|
ASSERT Fixed
|
2017-05-16 15:32:48 +02:00 |
|
|
|
c06a4c2ecd
|
Fixed u0Hu0
|
2017-05-16 10:42:14 +02:00 |
|
|
|
767074ab95
|
Added runtime checks
|
2017-05-16 09:17:16 +02:00 |
|
|
|
1c3d8f6a09
|
Fixed bug in u0Hu0
|
2017-05-15 12:33:41 +02:00 |
|
|
|
bdd1985ded
|
Commented out sqrt(N) algorithm
|
2017-05-11 17:28:27 +02:00 |
|
|
|
7801c57de9
|
Fixed bug in selection
|
2017-05-11 10:56:33 +02:00 |
|
|
|
2a6b86d0ac
|
Fixes previous commit
|
2017-05-10 22:11:42 +02:00 |
|
|
|
a08d0ad220
|
Debug in push/pull
|
2017-05-10 22:09:53 +02:00 |
|
|
|
7716ed24d1
|
Memory leak
|
2017-05-10 21:50:25 +02:00 |
|
|
|
60c4bac5ce
|
Fixed segfault
|
2017-05-10 21:33:53 +02:00 |
|
|
|
b3e3e926a5
|
Fixed
|
2017-05-10 20:56:47 +02:00 |
|
|
|
e1b090b76b
|
Fixed selection
|
2017-05-10 20:42:14 +02:00 |
|
|
|
859aa648fc
|
Accelerated selection : no more O(N2)
|
2017-05-10 15:06:03 +02:00 |
|
Thomas Applencourt
|
9bc888729e
|
Fix #194
|
2017-05-09 21:46:34 -05:00 |
|
Thomas Applencourt
|
5e2309246c
|
Merge amazing pull request #193 from scemama/master
Improved Stochastic PT2
|
2017-05-09 21:39:58 -05:00 |
|
|
|
a1367c13bc
|
Merge branch 'LCPQ-master'
|
2017-05-10 01:35:03 +02:00 |
|
|
|
ed7aeac2f6
|
Cleaned PT2 stoch
|
2017-05-10 01:34:29 +02:00 |
|
Anthony Scemama
|
0dc83e7f0e
|
Merge pull request #192 from TApplencourt/master
Add stuff useful for PBC support
|
2017-05-10 01:33:50 +02:00 |
|
|
|
500bf757e3
|
Introduced Abort Keyword
|
2017-05-10 00:04:34 +02:00 |
|
|
|
ff20894479
|
Simplified PT2 stoch
|
2017-05-09 23:26:27 +02:00 |
|
|
|
cbafcb5f55
|
Restored PUSH/PULL
|
2017-05-09 21:34:01 +02:00 |
|
|
|
92832b8ed6
|
Fixed pt2 stoch
|
2017-05-09 21:21:16 +02:00 |
|
|
|
04e1a90c6a
|
PT2 stoch fixed, new algo teeth
|
2017-05-09 19:17:07 +02:00 |
|
