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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-06-15 09:05:17 +02:00
Commit Graph

103 Commits

Author SHA1 Message Date
e4ce9ef219 Upgrade trexio version in configure
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2024-04-03 15:32:56 +02:00
62386b2dbd Set qmckl as optional 2023-11-07 10:42:19 +01:00
6b4b7afbe4
Merge branch 'macos' into dev-stable 2023-10-23 15:30:35 +02:00
a4a799837b Fix natorb with numerical integrals of Jastrow 2023-10-13 15:10:51 +02:00
106a2eafff Update qmckl
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2023-10-06 11:46:24 +02:00
145e18f394 Fixed openmp bug
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2023-09-26 18:39:13 +02:00
4cbe630ec5 Add many call provide in TC 2023-09-22 16:26:58 +02:00
c47a09f9c9 Fix multiple qmckl or trexio installations 2023-09-19 13:34:41 +02:00
1f14e707b4 Fix fortran mod file 2023-09-19 11:32:27 +02:00
2b3bf4fc00 Installation of QMCkl
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2023-09-18 18:14:04 +02:00
df07c65980 Fixed trexio installation
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2023-05-14 10:07:50 +02:00
a2627e7925 Introduced TREXIO in QP 2023-05-12 16:04:45 +02:00
f0b71bc2b0 Add libtrexio in configure 2023-05-10 18:06:50 +02:00
750ec9ca00 Fix f77zmq
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2023-04-19 09:31:36 +02:00
85ba1583d5 Fix configure for Linux 2023-04-18 14:45:44 +02:00
b51679b35e Fix zcat 2023-04-18 11:23:20 +02:00
b567cd891f Fix f77zmq 2023-04-18 10:00:38 +02:00
c4445d9a61 Fix qp2_dependencies branch 2023-02-24 16:33:28 +01:00
70726f73ab Updated dependencies + configure single branch 2023-02-08 13:30:59 +01:00
f92aa16dfd Force reinstallation of ocaml when configure -i 2023-02-07 16:11:47 +01:00
e71a3d8269 Update for ARM: Use OPAMPACK 2023-02-07 16:10:47 +01:00
cf5e951311 Force reinstallation of ocaml when configure -i
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2023-02-06 18:15:35 +01:00
4220e2cb9b Update for ARM: Use OPAMPACK 2023-02-06 13:43:09 +01:00
ed5419390c Update for bats 1.7 2023-02-06 13:42:20 +01:00
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