Commit Graph

40921 Commits

Author SHA1 Message Date
3e7642bc8c fix artifact names, allow to run quick test with a given input list 2024-10-14 09:43:08 -05:00
383ae086e5 skip in.icos due to the minimize command 2024-10-13 22:54:54 -05:00
4773b3e7e4 fix indentation in the config files 2024-10-13 15:48:29 -05:00
0d894c33c4 adjust the workflow files and config file 2024-10-13 11:52:10 -05:00
c735dc7d53 skip in.min.box, ensure that input lists only contain unique entries 2024-10-13 08:21:00 -05:00
3e64966800 filter out examples/fire 2024-10-12 23:53:35 -05:00
29e6ca0044 filter out input scripts for testing, remove concurrent (matrix) testing 2024-10-11 16:18:33 -05:00
b960cb213f revert to building with basic.cmake preset and manually include packages, refactor the get_kokkos_input script 2024-10-11 15:36:18 -05:00
e9ff0d3402 modify the kokkos workflow file 2024-10-11 14:42:45 -05:00
8f76fcdc54 Added a python script to get the example inputs that contain KOKKOS styles and generate the input lists for regression tests 2024-10-11 14:18:43 -05:00
63a26b1770 add the missing log file using --gen-ref 2024-10-08 12:10:48 -05:00
63649979e3 revert the file names and the upload action step 2024-10-08 10:55:40 -05:00
0e3a6a7190 turned on verbose to check tolerances and also print that info out to the run.log file 2024-10-08 10:51:12 -05:00
900f472ea6 test logic to run with different nprocs than the ref files if nprocs is specified 2024-10-07 16:39:26 -05:00
09a115cb89 add and switch to a workflow file dedicated for OpenMP backend for KOKKOS 2024-10-07 15:04:28 -05:00
7b3762881e try with 4 procs 2024-10-07 13:14:35 -05:00
076bb056aa fixed leftover typos in the workflow file and the tester 2024-10-07 12:59:48 -05:00
31f10f9675 add a workflow file for testing KOKKOS with the OpenMP backend 2024-10-07 12:04:29 -05:00
84c1492ce6 fix issues with invalid subfolders, with total walltime reference that may be zero, with the output of progress.yaml for easy parsing to dictionaries, modify config_kokkos.yaml for testing with the OpenMP backend 2024-10-07 12:01:59 -05:00
224468d946 Merge pull request #4346 from cjknight/lubricate_patch
features + bug fixes for granular simulations w/ Kokkos
2024-10-04 20:54:12 -04:00
70cbf051fe apply clang-format 2024-10-04 19:41:59 -04:00
47b918499f silence compiler warnings, remove dead code 2024-10-04 19:05:35 -04:00
2c738669ff compute_temp_sphere does not modify positions 2024-10-04 16:16:02 -06:00
b494a486a1 cosmetic 2024-10-04 17:59:44 -04:00
5786914b67 Merge branch 'lubricate_patch' of github.com:cjknight/lammps into lubricate_patch 2024-10-04 17:35:06 -04:00
27954609b8 Disallow newton on with full neigh list 2024-10-04 15:25:38 -06:00
aec43d0f00 Merge branch 'develop' into lubricate_patch 2024-10-04 17:09:27 -04:00
36dd4de3bc Merge pull request #4348 from akohlmey/collected-small-changes
Collected small changes and fixes
2024-10-04 15:57:47 -04:00
8827dec5a9 Small refactor 2024-10-04 13:04:20 -06:00
0a6d25881b update documentation according to accelerated style include check 2024-10-04 13:54:04 -04:00
25afdcc325 add check for missing or unneeded accelerated style include 2024-10-04 13:52:12 -04:00
9108168ea3 doc 2024-10-04 11:35:46 -05:00
b2e8648e6c enable deprecated APIs for HDF5 2024-10-04 12:32:09 -04:00
08266b65e4 doc 2024-10-04 15:45:16 +00:00
c4b4b7b874 suppress nvcc warnings with libfmt version 11.0.2 2024-10-04 11:33:33 -04:00
f7cf859670 doc 2024-10-04 15:32:47 +00:00
2ae4062a6b Merge pull request #4343 from akohlmey/collected-small-changes
Collected small changes and fixes
2024-10-04 03:59:49 -04:00
01468e2720 Merge branch 'collected-small-changes' of github.com:akohlmey/lammps into collected-small-changes 2024-10-04 01:41:57 -04:00
6d8529f1f7 Merge branch 'develop' into collected-small-changes 2024-10-04 01:24:30 -04:00
1263a23e9c Merge pull request #4345 from akohlmey/update-fmtlib
Update embedded copy of libfmt to version 11.0.2
2024-10-04 01:22:51 -04:00
d1a1a57bd9 Merge pull request #4339 from jtclemm/small-patches
Fixing bugs in GRANULAR and mistakes in RHEO documentation
2024-10-03 22:01:21 -04:00
3776ff938d Need to use vflag_either instead of vflag_global 2024-10-03 16:36:05 -06:00
98ad09b0c9 Tighten up check even more 2024-10-03 16:17:39 -06:00
d0f6f21c39 Use wrapper and remove sync to host 2024-10-03 16:17:06 -06:00
a26c81d73b Revert changes to pair lubricate base class 2024-10-03 15:59:27 -06:00
d6562b7514 fix-whitespace 2024-10-03 19:30:09 +00:00
0e10ed24fe fix compilation issue with MSVC++ 2024-10-03 15:19:56 -04:00
f25c530c04 recover compilation with MSVC++ 2024-10-03 14:56:28 -04:00
fbc6ba4ef4 import libfmt 11.0.1 2024-10-03 14:43:19 -04:00
4bf92cc846 update kokkos install to include brownian 2024-10-03 18:35:02 +00:00