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mirror of https://github.com/TREX-CoE/qmckl.git synced 2024-12-23 04:44:03 +01:00
Commit Graph

1243 Commits

Author SHA1 Message Date
0ae0f68d01 Python script to build makefiles 2021-05-12 23:16:09 +02:00
7b7c8242bd Fix CI 2021-05-12 13:36:25 +02:00
0fdaea77c9 Fix CI 2021-05-12 13:35:38 +02:00
ea8804ae19 MacOS CI 2021-05-12 13:33:14 +02:00
1516f06e03 Multi-arch CI 2021-05-12 13:24:35 +02:00
abb30cf8e2 Add css file 2021-05-12 02:47:55 +02:00
b437cb5ce9 Fix CI 2021-05-12 02:41:29 +02:00
d22ab667fd Fix CI 2021-05-12 02:33:47 +02:00
c3bd5cd732 Fixing CI 2021-05-12 02:25:23 +02:00
62d04409b1 Cleaning 2021-05-12 02:20:39 +02:00
95b9d77e84 Workflows 2021-05-12 02:16:45 +02:00
5c40916bf3 Fixed module depend 2021-05-12 01:51:26 +02:00
4adcfa1df4 Complete build OK 2021-05-12 00:22:51 +02:00
0ee57d06e0 Working on documentation 2021-05-11 17:03:13 +02:00
ee9e3c5b55 Removed need for munit 2021-05-11 16:47:22 +02:00
d4711206f0 Introduced qmckl.h in org files 2021-05-11 13:57:23 +02:00
a4e49f4939 Added tests 2021-05-11 12:56:41 +02:00
90474fee2d parallel tangle OK 2021-05-11 12:34:12 +02:00
c61556ef77 Working on automake 2021-05-11 11:45:49 +02:00
18ef3a02b8 Automake working 2021-05-10 23:56:26 +02:00
0cb247e682 Fixing distcheck 2021-05-10 10:55:22 +02:00
f524eeb22c config.h fixed 2021-05-10 10:41:59 +02:00
8b9b671c84 Improve build system 2021-05-10 10:05:50 +02:00
66d606ff1e -DHAVE_CONFIG_H 2021-05-09 02:12:38 +02:00
e2ee986032 Added VPATH 2021-05-09 01:27:07 +02:00
8479039078 Fixed -Werror in gfortran 2021-05-09 01:07:17 +02:00
c6388867a6 Add --without-munit 2021-05-07 13:16:46 +02:00
a84fca166d Fixed actions 2021-05-07 13:02:16 +02:00
9612208161 Fixed actions 2021-05-07 12:58:30 +02:00
cad6fa59a9 Merge branch 'master' of github.com:TREX-CoE/qmckl 2021-05-07 12:56:22 +02:00
2bb844dd59 Added configure scripts 2021-05-07 12:47:56 +02:00
0dffa4ce4c Cleaned Makefile 2021-05-04 17:10:20 +02:00
27d8733656
Merge pull request #14 from v1j4y/en-distance_vj
[WIP] electron nuclear distances
2021-05-04 10:49:30 +02:00
c2d02f755b Added DESTDIR in Makefile 2021-04-30 01:55:50 +02:00
58f4113a99 Added missing css file 2021-04-30 01:34:10 +02:00
e2e46d0714 Moved documentation in share/doc 2021-04-30 01:26:19 +02:00
vijay gopal chilkuri
e461622868 Went through configure. Everything looks OK. Fixed a few typos. #13 2021-04-29 11:48:27 +05:30
vijay
afed24ff40
Merge pull request #4 from TREX-CoE/master
Merge with main repo.
2021-04-29 07:48:50 +02:00
79c9651021 Fix makefile 2021-04-28 13:30:04 +02:00
bc85565586 small changes 2021-04-28 12:08:53 +02:00
f0f6ac7d85 Added ee-distance computation 2021-04-26 01:47:29 +02:00
b56a13be66 FIxed distcheck 2021-04-21 13:30:02 +02:00
56ba68b7f8 Fixed text in org file 2021-04-21 13:26:11 +02:00
8882b4b3d4 Fix htmlize 2021-04-21 13:17:33 +02:00
59d56f6b27 Hide code in doc 2021-04-21 13:00:24 +02:00
399a632bdd Add doc in dist, and text doc 2021-04-21 12:44:03 +02:00
e18655b147 Added qmckl_electron 2021-04-21 01:56:47 +02:00
03c0abbf4e Added gitignore 2021-04-21 00:00:38 +02:00
6d83abe736 Added make distcheck 2021-04-20 19:10:36 +02:00
3618cde7b1 Cleaned Makefiles 2021-04-20 18:33:36 +02:00