fd8fb74a88
cannot use Kokkos-OpenMP with recent hipcc
2025-05-15 07:47:19 -04:00
35f08232ba
update for Fedora 41/42
2025-05-15 07:46:48 -04:00
c088ce2f51
fix typo
2025-04-19 11:05:52 -04:00
b6dae216d3
no need to set build type specific flags
2025-04-07 22:48:18 -04:00
cdea2737c7
remove CMAKE_TUNE_FLAGS
2025-04-06 07:06:20 -04:00
9b1dca201f
rewrite incorrect statement
2025-03-06 15:45:24 -05:00
8a176ac488
use MKL for FFTs and on Intel GPU
2024-10-06 15:09:06 -04:00
4da644958e
IntelLLVM is not ABI compatible with generic BLAS libraries. Use linalg instead
2024-10-05 03:39:00 -04:00
39f42d4c12
simplify
2024-10-05 01:56:31 -04:00
1ac9f0801c
update build support for using LAPACK with RHEO instead of GSL
2024-09-18 19:55:59 -04:00
42b6c0f62c
enable cmake support
2024-09-03 20:10:29 +00:00
4d6b998a75
flang may be called flang-new
2024-08-22 00:00:27 -04:00
66552d80da
Merge branch 'develop' into rheo
2024-07-03 03:42:44 -04:00
cdb4a331a6
remove INTEL package from cross-compiler config.
...
It doesn't do much goos since we're not using an Intel compiler
and we are running out of capacity for auto-exported symbols
for the LAMMPS shared library (limited to 65k).
2024-06-27 06:27:58 -04:00
b219bb8de8
Merge conflicts
2024-06-24 14:09:33 -06:00
487a9ae73e
return to alphabetical order
2024-06-23 03:09:54 -04:00
cb0af02748
Merge pull request #4193 from akohlmey/extra-command-package
...
Create new EXTRA-COMMAND package
2024-06-19 15:06:20 -04:00
d61c94c0f3
move group2ndx and ndx2group to new EXTRA-COMMAND package. update docs.
2024-06-10 14:14:36 -04:00
7e09353e7c
add ML-UF3 to compatible CMake preset files
2024-03-27 06:28:23 -04:00
e0c0b2fe7e
fix cmake syntax error
2024-03-05 15:28:21 -05:00
16b631858f
fix typo
2024-02-21 10:02:01 -05:00
faef34a8d4
Merge branch 'develop' into rheo
2024-01-12 13:26:38 -07:00
073a72d933
fixing merge conflicts
2024-01-12 11:12:02 -07:00
8090af5649
Merge branch 'develop' into issue3775_fft_kokkos
2024-01-04 21:11:54 -05:00
e26a762f88
improve compatibility of oneapi.cmake preset
2024-01-04 11:21:38 -05:00
cddce67931
Merge branch 'develop' into issue3775_fft_kokkos
2023-12-18 12:14:15 -05:00
bc47f4f3a3
Updated CMake preset files for kokkos-cuda and kokkos-hip
2023-12-18 11:56:23 -05:00
e51a8ccfbf
Removed the unnecessary line since CUDA_BUILD_MULTIARCH is ON by default
2023-12-07 12:00:24 -06:00
e53b3c76f5
Updated doc pages for the added pair styles, added a cmake preset for gpu-cuda, added "comm_modify vel yes" to in.mdpd
2023-12-05 15:32:57 -06:00
e4149035fa
restore using nvcc_wrapper with kokkos-cude.cmake preset
2023-11-25 05:58:43 -05:00
a9f15f6a29
update preset
2023-09-21 19:09:57 -04:00
a81412f015
remove MPIIO sources and references to them. update Purge.list and build systems
2023-08-20 21:51:33 -04:00
7d84eb86f7
Merge remote-tracking branch 'github/develop' into collected_small_fixes
2023-08-03 21:01:08 -04:00
6e9a6e6b0b
Merge pull request #3856 from akohlmey/remove-mscg-package
...
Remove MSCG package from LAMMPS distribution
2023-08-03 17:29:56 -04:00
fbf0bad3b5
correct sort order
2023-08-03 14:30:32 -04:00
cefb38a000
update package list for Windows with MSVC
2023-08-03 14:30:21 -04:00
c99d0f5452
cmake cleanups
2023-08-02 04:58:38 -04:00
66403c93ad
add preset and support for building serial multi-arch macOS executables
2023-07-18 18:55:27 -04:00
9b7bd71ab6
remove MSCG package from LAMMPS distribution
2023-07-16 21:04:58 -04:00
7cfe45c00b
Adding gsl version, cmake options, readme files
2023-04-25 10:29:39 -06:00
35d1178cfa
Adding cmake options, fixing a few misc errors
2023-04-20 20:15:17 -06:00
0965d9da2b
remove references to LATTE packages in CMake scripts
2023-03-29 17:33:38 -04:00
4d545b3539
remove Fortran library and the styles based on it from MESONT package
2023-01-20 18:29:54 -05:00
3f496905d6
Merge branch 'develop' into lepton-package
2023-01-06 00:44:28 -05:00
9d06a3b9a1
with linalg now being C++, a few more packages can be built natively on Windows
2022-12-28 17:18:33 -05:00
cf0fb7f5df
build system updates for presets and dependencies
2022-12-21 21:32:27 -05:00
1df948b26b
add ML-POD package to relevant CMake presets
2022-11-27 17:16:13 -05:00
0d47dc250a
drop special OpenMP flags from presets. Will be detected by FindOpenMP.
2022-10-26 22:37:04 -04:00
90b590dd3b
synchronize intel compiler flag tweaks with cmake, turn off one more warning
2022-10-08 10:54:33 -04:00
8030fc09e3
augment clang preset so that it switches the fortran standard for flang
...
flang (the one officially included in clang) currently only supports f2018
2022-09-10 02:48:16 -04:00
