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mirror of https://github.com/TREX-CoE/trexio.git synced 2025-01-09 20:48:53 +01:00
Commit Graph

86 Commits

Author SHA1 Message Date
2c7d8eab7f Fixed bug in test_f.f90 2024-11-12 15:19:53 +01:00
e8ac919678 Removed O2 from default fortran configuration 2024-11-12 12:00:19 +01:00
q-posev
c9029293d2 Fix a typo in the comment 2024-11-11 20:03:40 +01:00
ff8e44d386 Add -g to compiler flags 2024-11-11 03:27:05 +01:00
q-posev
d88358fb7b
[skip ci] Bump the patch version following 2.5.0 release 2024-09-11 10:20:56 +02:00
Max Hoffer
e16d6ad00d Adding new error msg for hf5 2024-03-15 11:24:02 +01:00
Evgeny Posenitskiy
5cb0894cb2
Introduce test for version 2023-10-27 13:07:48 +02:00
8a2067d995 Bump version to 2.4.2 2023-10-24 19:54:10 +02:00
ccdf359a90 Update version to 2.4.1 2023-10-24 10:23:04 +02:00
efd7fab7ed state_id is an index+added energy 2023-05-12 01:33:57 +02:00
7edde4f1fb Bump to version 2.3.2 with #118 2023-05-11 23:08:37 +02:00
d4d6da9850 Fix no-HDF5 2023-05-10 16:02:57 +02:00
13567fceb8 [wheel build] Set version number to 2.3.1 for fixing text backend in python 2023-04-26 10:10:42 +02:00
fbd44013db
Bumd the minor version after the release 2023-04-03 22:45:54 +02:00
fb711e1bed Fixed #111 2023-01-20 10:31:56 +02:00
37fd013f6c Improve HDF5 detection 2023-01-19 01:21:49 +01:00
fc7ddaddc0 Fixing HDF5 detection 2023-01-19 00:14:01 +01:00
0bda2330c7 Fix confgure.ac 2023-01-16 19:29:06 +01:00
5742221eb2 If header is not found, try pkgconfig 2023-01-16 19:26:52 +01:00
aa4e9ca7d3 Fixed pkg-config 2023-01-16 19:18:58 +01:00
8da5c2215b Removed dependency on hdf5_hl 2023-01-16 14:54:17 +01:00
9355609ced Rewrote HDF5 detection 2023-01-13 15:47:23 +01:00
69aa17862c configure tries cp -r -n 2023-01-05 10:28:07 +01:00
fefc01b46b Added trexio_cp 2023-01-03 18:29:21 +01:00
fb1dcb5fca Added 'AM_PROG_CC_C_O' in 'configure.ac' 2022-12-13 17:09:10 +01:00
158f99bde9 Merge branch 'master' of github.com:TREX-CoE/trexio 2022-12-13 17:08:05 +01:00
4ac593351c hdf5_hl 2022-12-13 17:07:57 +01:00
Evgeny Posenitskiy
34629c7d97
Update Debian files (#100)
* Change debian files to avoid conflicts when packaging
2022-09-27 13:54:54 +02:00
5b5730ed81 Do not rely on the .git folder for TREXIO_DEVEL setup
This poses issues when packaging for Guix and Debian
2022-09-26 17:06:04 +02:00
cd48a74fd7 Fixed 'warning: cannot check for file existence when cross compiling' 2022-09-06 17:19:38 +02:00
1fde6f9aa1 Optionally disable the Fortran tests in the user mode 2022-09-06 11:52:36 +02:00
e8dffaac15 Manually append -fPIC flag
This solves issues with some compilers, e.g. Intel ones, which fail to resolve some linking symbols when configured in a simple manner (./configure CC=icc FC=ifort)
2022-07-12 17:07:38 +02:00
6d0293a379 Disable the malloc check to improve cross-compilation
For example, compiling with gcc compiler with -fsanitize=address flag with use a different library for malloc-ing. This will fail if Autoconf add some symbols due to the use of AC_FUNC_MALLOC
2022-07-08 18:12:50 +02:00
189f6de6a9 Upgrade the minor versions after the release 2022-06-03 11:37:02 +02:00
3078f825e7 Revert "Upgrade the minor version before the release"
This reverts commit 22531b47eb.
2022-06-03 09:51:31 +02:00
22531b47eb Upgrade the minor version before the release 2022-06-03 09:49:15 +02:00
f00505a763 Add configure --with-efence to debug memory issues 2022-05-06 11:07:26 +02:00
73d24e6def Merged pseudo 2022-02-23 18:40:55 +01:00
6ab5c67ebe [pre-release] upgrade versions and produce wheels for CPython 3.10 2021-12-27 16:26:17 +01:00
f89481fe60 Merge branch 'master' into cmake-and-guix 2021-11-18 13:59:05 +01:00
c5c4b7e473 Remove 2nd occurence of LT_INIT 2021-11-17 14:22:48 +01:00
4e20a5fde3 Modernize configure.ac 2021-11-17 14:16:55 +01:00
297552418b add AC_CONFIG_AUX_DIR 2021-11-13 18:04:52 +01:00
42bf7ce94c Store Git hash 2021-11-08 19:41:17 +01:00
cce0f49785 use HAVE_HDF5 instead of DO_HDF5 for conditional compilation 2021-11-02 10:32:51 +01:00
7d00b87ad8 Merge branch 'master' into optional-hdf5 2021-11-01 11:58:50 +01:00
d42dc7f449 optional HDF5 compilation
via configure script and pre-processor macros
2021-11-01 11:55:34 +01:00
3154e01021 Merge branch 'configure' of github.com:TREX-CoE/trexio into configure 2021-11-01 10:16:14 +01:00
f0dd4563bc Automatic developer mode 2021-11-01 10:16:02 +01:00
0a6c1dc65f Removed TREXIO_DEVEL in configure 2021-11-01 10:02:25 +01:00