|
|
bf68146dc5
|
make_binary.sh
|
2018-10-29 16:36:09 +01:00 |
|
|
|
9f756a51bd
|
make_static
|
2018-10-29 16:29:40 +01:00 |
|
|
|
8274044a7c
|
Check for duplicates in parallel
|
2018-10-29 16:12:37 +01:00 |
|
|
|
9a70059a11
|
Added variance and norm of PT
|
2018-10-29 14:35:29 +01:00 |
|
|
|
7a0a14854a
|
Modified build_static
|
2018-10-24 18:36:39 +02:00 |
|
|
|
fec8deb8e8
|
Forgot NEED in Tools
|
2018-10-24 12:23:12 +02:00 |
|
|
|
cadb6a74dc
|
Minor change in static
|
2018-10-24 12:14:49 +02:00 |
|
|
|
08ab6fab22
|
Fixed travis
|
2018-10-23 23:49:12 +02:00 |
|
|
|
9b1fa6a2fe
|
User's guide
|
2018-10-23 23:43:28 +02:00 |
|
|
|
bc01ff40d7
|
User's guide
|
2018-10-23 23:37:51 +02:00 |
|
|
|
8983614ed0
|
Fixed travis
|
2018-10-23 22:46:05 +02:00 |
|
|
|
f9d4a0e647
|
Added requirements for RTD
|
2018-10-23 01:33:26 +02:00 |
|
|
|
47d625df3b
|
Doc: Started Programming
|
2018-10-23 01:19:44 +02:00 |
|
|
|
1c6991b323
|
Doc: Benchmarks
|
2018-10-23 01:13:32 +02:00 |
|
|
|
d40f7d1568
|
Forgot file
|
2018-10-22 23:35:05 +02:00 |
|
|
|
ffed848fa1
|
References
|
2018-10-19 18:37:58 +02:00 |
|
|
|
c5fa0bfa31
|
Added references
|
2018-10-19 18:20:26 +02:00 |
|
|
|
bf0a68e9b1
|
Fixed travis
|
2018-10-19 17:43:12 +02:00 |
|
|
|
db97464c1e
|
Merge branch 'master' of github.com:scemama/quantum_package
|
2018-10-19 17:09:03 +02:00 |
|
|
|
ff37982d15
|
A lot of cleaning
|
2018-10-19 17:08:38 +02:00 |
|
Anthony Scemama
|
d896285b73
|
Set theme jekyll-theme-modernist
|
2018-10-19 17:02:13 +02:00 |
|
|
|
5b6067ea2f
|
Cleaning plugins
|
2018-10-19 11:32:58 +02:00 |
|
|
|
030ce60c31
|
Start writing documentation for ReadTheDocs.
|
2018-10-19 01:06:18 +02:00 |
|
|
|
996bb68684
|
Conlict with python decorator package
|
2018-10-18 11:16:52 +02:00 |
|
|
|
1e0597dfee
|
Fixed masks in MRCC
|
2018-10-17 20:06:39 +02:00 |
|
|
|
ec0db34ce5
|
OCaml version
|
2018-10-17 19:33:45 +02:00 |
|
|
|
a289df5503
|
Updated OCaml
|
2018-10-17 19:27:58 +02:00 |
|
|
|
bfa9fa8637
|
Cleaned one-electron integrals
|
2018-10-17 18:51:41 +02:00 |
|
|
|
75790e6972
|
Fixed ao_overlap ezfio problem
|
2018-10-17 16:16:05 +02:00 |
|
|
|
6566529ec4
|
1e integrals in EZFIO
|
2018-10-17 15:56:55 +02:00 |
|
|
|
ee13470949
|
2RDM
|
2018-10-16 16:40:04 +02:00 |
|
|
|
e2b4b1f58d
|
Init lindex=0
|
2018-10-15 19:04:05 +02:00 |
|
|
|
fc01113383
|
Fixed quicksort openmp
|
2018-10-15 14:49:08 +02:00 |
|
|
|
b3d17a6479
|
Fixed quicksort openmp
|
2018-10-15 12:16:21 +02:00 |
|
|
|
22b9eb4fb9
|
Fixed bug related to ncache
|
2018-10-15 11:33:10 +02:00 |
|
|
|
665ece19e5
|
Merge branch 'master' of github.com:scemama/quantum_package
|
2018-10-15 11:20:27 +02:00 |
|
|
|
3a23f4933e
|
FCIdump module updated from @eginer
|
2018-10-15 11:18:45 +02:00 |
|
|
|
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 |
|
