|
|
6bf9388a4e
|
Added control of precision in AOs
|
2023-11-28 17:00:39 +01:00 |
|
|
|
063aada9e4
|
Added --with-icx
|
2023-11-28 12:44:35 +01:00 |
|
|
|
5d8dfacffe
|
Bump version to 0.5.4
|
2023-10-06 11:35:02 +02:00 |
|
|
|
a7523fbf77
|
Now using posix_memalign
|
2023-10-06 11:33:33 +02:00 |
|
|
|
5118359099
|
Bump version
|
2023-09-26 17:37:17 +02:00 |
|
|
|
46785ddb7e
|
Fixing IVDEP CI
|
2023-09-15 10:23:29 +02:00 |
|
|
|
42222f73a5
|
Merge olympe2:qmckl
|
2023-09-14 11:01:13 +02:00 |
|
|
|
6919e16f9a
|
Update version to 0.5.2
|
2023-09-14 11:01:08 +02:00 |
|
|
|
561373fe4f
|
Improved configure for nvc
|
2023-09-14 11:00:24 +02:00 |
|
|
|
2291103a9b
|
Merge branch 'master' of github.com:TREX-CoE/qmckl
Conflicts:
org/qmckl_sherman_morrison_woodbury.org
|
2023-09-14 09:43:59 +02:00 |
|
|
|
fd2addb370
|
Added IVDEP and ALIGNED in configure.ac
|
2023-09-14 09:41:15 +02:00 |
|
|
|
3db1765cdb
|
Reduced OMP stack size
|
2023-09-13 13:23:16 +02:00 |
|
|
|
ecc19af2ba
|
Remove GPU from configure
|
2023-08-31 17:31:27 +02:00 |
|
|
|
5d1373a2fb
|
Version 0.4.1
|
2023-08-29 11:26:16 +02:00 |
|
|
|
db13db8afa
|
Enable FPE tracking
|
2023-06-29 15:56:11 +02:00 |
|
|
|
92705b7c87
|
Debugging Jastrow
|
2023-05-22 19:15:17 +02:00 |
|
Francois Coppens
|
2e45927e04
|
Added AVX2 detection to autoconfig script.
Fixed minor SIMD bug in tests.
|
2023-01-30 17:35:11 +01:00 |
|
|
|
9a779f2a94
|
Avoid SIMD length=127
|
2023-01-30 16:25:02 +01:00 |
|
|
|
f1bffe274b
|
Fix #95
|
2023-01-25 11:02:36 +01:00 |
|
|
|
4616467c4e
|
Added SIMD_LENGTH detection
|
2023-01-17 15:40:00 +01:00 |
|
|
|
088bca96f3
|
Fix maintainer mode
|
2022-11-24 16:21:11 +01:00 |
|
|
|
ca22f0c277
|
Maintainer mode file
|
2022-11-24 16:17:47 +01:00 |
|
|
|
3a3b03b2ce
|
Cleaning configure
|
2022-10-20 15:44:11 +02:00 |
|
|
|
245220211b
|
configure --without-python
|
2022-10-13 15:49:45 +02:00 |
|
|
|
1c5713f2f6
|
Add options for PGCC and PGF90 compilers
|
2022-10-13 10:30:56 +02:00 |
|
|
|
fe0ad737d8
|
Make --with-openmp default
|
2022-10-07 09:36:06 +02:00 |
|
|
|
0def40720d
|
Fixed --enable-hpc
|
2022-10-06 22:39:35 +02:00 |
|
|
|
5a0038e96f
|
Trying to fix pkgconfig
|
2022-10-06 10:26:49 +02:00 |
|
|
|
c66be3602a
|
debug flags
|
2022-10-06 10:22:59 +02:00 |
|
|
|
de6b2d27f3
|
Fix bug in configure
|
2022-09-28 18:00:16 +02:00 |
|
|
|
5c62bc1c71
|
Added --disable-doc to configure
|
2022-09-28 17:52:33 +02:00 |
|
Aurelien Delval
|
eab4e56c18
|
Add the Verificarlo probes library to LDFLAG
|
2022-09-27 14:09:34 +00:00 |
|
Aurelien Delval
|
f10a2fe91e
|
Modify the vfc_ci wrapper and its config
- init and dump have to be called manually
- Few config changes to fix CI
|
2022-09-27 13:37:06 +00:00 |
|
|
|
858bdbf7f4
|
Cleaned qmckl_dgemm integration
|
2022-09-22 16:43:57 +02:00 |
|
|
|
8c388a93b7
|
Improve configure
|
2022-09-22 13:56:52 +02:00 |
|
|
|
eba2873316
|
Clean configure file
|
2022-09-22 13:37:29 +02:00 |
|
v1j4y
|
e0513e6d4a
|
Configure script for qmckl_dgemm.
|
2022-08-09 16:01:26 +02:00 |
|
|
|
a2b4e515e8
|
Bump version to 0.3.1
|
2022-08-07 16:01:03 +02:00 |
|
|
|
9ec3d19777
|
Add AddressSanitizer to the debug configure
|
2022-07-11 10:20:50 +02:00 |
|
|
|
49e535feb9
|
Moved python in Makefile.am
|
2022-06-29 10:34:26 +02:00 |
|
|
|
e00e034497
|
Merge branch 'master' into add-python-api
|
2022-05-20 19:19:42 +02:00 |
|
|
|
d1e88ad475
|
Fixed efence compilation
|
2022-05-06 11:29:46 +02:00 |
|
|
|
0ea5405004
|
Add SWIG and pyqmckl ingredients for Autotools
|
2022-05-03 16:48:27 +02:00 |
|
Aurelien Delval
|
69009900f7
|
Revert cuBLAS to old config
|
2022-04-08 11:37:37 +02:00 |
|
Aurelien Delval
|
ad531dddf9
|
Configure cuBLAS with --enable-gpu and clean code
|
2022-04-08 11:11:15 +02:00 |
|
|
|
07cc64bb31
|
Changed enable-cublas into with-cublas
|
2022-04-08 10:32:38 +02:00 |
|
|
|
47d63aa9d3
|
Fix cublas
|
2022-04-07 17:02:36 +02:00 |
|
|
|
6c7634038f
|
Improve configure
|
2022-04-06 13:48:37 +02:00 |
|
|
|
0d5d14b8e4
|
Fix openacc
|
2022-04-06 11:51:36 +02:00 |
|
2323
|
72fad819bf
|
Fix flags
|
2022-04-06 10:03:56 +02:00 |
|
