|
|
6fd5cd08b6
|
Added trexio installation in configure
|
2022-07-01 11:16:46 +02:00 |
|
|
|
6861cea2ac
|
Compiles with OCaml 4.13.1
|
2022-06-08 11:08:53 +02:00 |
|
|
|
afb2210175
|
Fix error message in configure
|
2022-01-25 22:40:01 +01:00 |
|
|
|
8c39fffd4c
|
Upgrade to resultsFile v2.3
|
2021-12-20 19:05:13 +01:00 |
|
|
|
1b6fb2e607
|
More portable install script
|
2021-11-16 23:35:30 +01:00 |
|
|
|
b8c9836b74
|
Updated f77zmq
|
2021-11-16 19:22:54 +01:00 |
|
|
|
81d0e9e5ac
|
Removing faketty in configure
|
2021-07-07 17:44:15 +02:00 |
|
|
|
906d96c4df
|
Simpler installation
|
2021-07-05 19:14:59 +02:00 |
|
|
|
6773acac06
|
add qp2-dependencies
|
2021-07-05 18:15:26 +02:00 |
|
|
|
49fc21a9fa
|
configure
|
2021-07-05 16:53:34 +02:00 |
|
|
|
11f2bd400a
|
Simplified ocaml installation
|
2021-07-05 15:37:33 +02:00 |
|
|
|
b45339b791
|
Fixed libcap problem on Jewels
|
2021-04-16 16:36:35 +02:00 |
|
|
|
c923aba44a
|
Revert configure
|
2021-04-16 16:33:29 +02:00 |
|
|
|
886cfe6326
|
Update configure
|
2021-04-16 15:38:56 +02:00 |
|
|
|
d55acad33f
|
libcap without gperf
|
2021-03-03 14:22:37 +01:00 |
|
|
|
9cce1a98e7
|
bump ocaml version
|
2021-02-15 13:37:33 +01:00 |
|
Travis
|
b4fce4c594
|
Fixed gmp
|
2020-12-29 01:27:40 +01:00 |
|
|
|
f120fb8177
|
Irpf90 and EZIO as submodules
|
2020-12-06 21:27:28 +01:00 |
|
|
|
bae22bd940
|
Update irpf90
|
2020-12-06 17:03:10 +01:00 |
|
|
|
b14f9af26e
|
Added the GMP tar.gz to reduce pressure on GMP server.
|
2020-12-06 16:12:59 +01:00 |
|
|
|
c35212d111
|
EZFIO
|
2020-12-06 15:19:26 +01:00 |
|
|
|
835c1eb3ae
|
IRPF90 version
|
2020-12-05 17:03:57 +01:00 |
|
|
|
faa66ecb35
|
IRPF90 version
|
2020-12-05 17:03:04 +01:00 |
|
|
|
dd384764f0
|
Fixed configure -i all
|
2020-12-05 16:30:26 +01:00 |
|
|
|
46cc5048dc
|
Merge branch 'csf' of github.com:QuantumPackage/qp2 into csf
|
2020-12-05 16:29:41 +01:00 |
|
|
|
951428837b
|
Update IRPF90 version
|
2020-12-05 16:29:36 +01:00 |
|
|
|
1673b20d1f
|
Error message
|
2020-12-04 11:03:51 +01:00 |
|
|
|
fce69d05f1
|
Basis sex -> Basis set
|
2020-08-26 10:19:40 +02:00 |
|
|
|
5683fff109
|
Update EZFIO
|
2020-08-03 22:08:29 +02:00 |
|
|
|
79f47d024b
|
First python3 3 working installation
|
2020-03-17 18:02:29 +01:00 |
|
|
|
a4331ec6e4
|
Merge branch 'dev' into features_python3
|
2020-03-17 16:15:47 +01:00 |
|
|
|
28578c0562
|
use zmq_f77_free.h
|
2020-03-05 08:51:39 +01:00 |
|
|
|
3cf55e2676
|
print_energy.irp.f
|
2020-02-26 15:58:14 +01:00 |
|
|
|
6676c9fa7b
|
Merge branch 'dev' of github.com:QuantumPackage/qp2 into dev
|
2020-02-20 20:53:20 +01:00 |
|
|
|
1e336c77c6
|
Fixed EZFIO installation
|
2020-02-20 19:41:30 +01:00 |
|
|
|
d7978912bd
|
Added the tgz of EZFIO for simplicity
|
2020-02-20 19:33:42 +01:00 |
|
|
|
2e1ed8ab79
|
Merge pull request #78 from QuantumPackage/master
Bugfix
|
2020-02-12 17:33:04 -06:00 |
|
|
|
978c0e5b3c
|
Fixed wrong path
|
2020-02-12 21:42:49 +01:00 |
|
|
|
6d10e4f0cc
|
Fix resultsFile Python2 download
|
2020-02-12 21:14:12 +01:00 |
|
|
|
4a58d5cc15
|
Updated configure
|
2020-02-12 21:12:19 +01:00 |
|
|
|
4572aa1661
|
Added qp_basis
|
2020-02-04 19:30:04 +01:00 |
|
|
|
ad8adda841
|
Documentation in configure
|
2020-02-04 19:04:36 +01:00 |
|
|
|
1191679173
|
Removed basis set files and added configure/install script
|
2020-02-04 18:33:41 +01:00 |
|
|
|
39be892bfe
|
Fixed sexplib version in configure
|
2020-01-07 09:25:00 +01:00 |
|
|
|
9a149e4cfb
|
Fixed selection weight on slaves
|
2019-11-19 18:59:34 +01:00 |
|
|
|
d00f55c28a
|
Update EZFIO
|
2019-10-27 23:48:25 +01:00 |
|
Emmanuel Giner LCT
|
4257399ca9
|
Compatibility with EZFIO v1.6.0
|
2019-10-24 21:41:54 +02:00 |
|
Emmanuel Giner LCT
|
40239f100c
|
Merge alors
|
2019-10-24 13:56:53 +02:00 |
|
Emmanuel Giner LCT
|
502e787323
|
added general svd for new mo
|
2019-10-24 13:44:40 +02:00 |
|
|
|
e61cf32ea3
|
Force GCC for dependencies
|
2019-10-21 17:40:54 +02:00 |
|
