Commit Graph

20761 Commits

Author SHA1 Message Date
1adda03202 cmake: only install shared lib and friends 2020-04-29 18:06:33 -06:00
600d357155 cmake: disable installing of static libs 2020-04-29 16:26:56 -06:00
5c2f0ecc65 Merge pull request #2045 from stanmoore1/kk_team_coul
Fix issue in Kokkos "team" energy
2020-04-29 15:32:45 -04:00
feed7302d5 Merge pull request #2044 from stanmoore1/kk_reax_full
Remove full neigh list option in Kokkos ReaxFF
2020-04-29 14:54:54 -04:00
e10d62c89f Fix energy tally issue 2020-04-29 10:06:09 -06:00
04388c26f8 Fix Kokkos view runtime issue 2020-04-29 10:05:47 -06:00
7508660d8a Merge pull request #2036 from stanmoore1/kk_dihedral_charmm
Fix issues in dihedral_charmm_kokkos
2020-04-29 10:24:32 -04:00
fe9e6736e1 Merge branch 'master' into kk_dihedral_charmm 2020-04-29 08:00:55 -06:00
910d00f500 Merge pull request #2041 from stanmoore1/kk_team_ev
Fix Kokkos issue and remove N2 neigh list option
2020-04-28 19:23:35 -04:00
17f7bf2fb9 Merge pull request #2035 from stanmoore1/kk_uvm
Fix UVM compile issues
2020-04-28 19:23:12 -04:00
e47dc6fec9 Merge pull request #2043 from ellio167/ubuntu-install-docs
Update ubuntu ppa install docs
2020-04-28 19:22:27 -04:00
a88364a2ea Tweak error message 2020-04-28 15:39:01 -06:00
754d9fabc6 Merge branch 'ubuntu-install-docs' of github.com:ellio167/lammps into ubuntu-install-docs 2020-04-28 17:27:49 -04:00
b3d8986603 list update kokkos flag 2020-04-28 17:27:23 -04:00
e9a777e63d Add explaination of potenentials directory behavior for lmp_daily 2020-04-28 16:16:28 -05:00
4bb5f99801 fix underline 2020-04-28 17:15:48 -04:00
fa0f10f2f5 Remove debug output 2020-04-28 15:15:26 -06:00
6ed2adcd31 Removed unused functions 2020-04-28 15:12:41 -06:00
62cdc9d6f1 Remove full neigh list option in Kokkos ReaxFF 2020-04-28 15:08:30 -06:00
c6dc0cf8c5 flag commands and paths as literals. 2020-04-28 17:03:20 -04:00
3392dca7b8 fix typos in manual 2020-04-28 16:45:02 -04:00
87ca8a0627 Update ubuntu ppa install docs 2020-04-28 15:38:41 -05:00
f5a8d40a51 Merge pull request #1906 from stanmoore1/kk_copycpu
Add method to copy Kokkos neighbor list to CPU list
2020-04-28 15:34:05 -04:00
32f5fd2373 Comment cleanup 2020-04-28 10:39:31 -06:00
712b8668cb Fix Kokkos neighlist issue and remove N2 option 2020-04-28 10:33:10 -06:00
21cb0d394f Merge branch 'master' into kk_copycpu 2020-04-28 11:56:22 -04:00
2e07345cea Merge pull request #2023 from akohlmey/collected-small-changes
Collected small changes and bugfixes
2020-04-28 11:52:54 -04:00
7863dfa1d2 Merge pull request #2033 from stanmoore1/kk_stencil
Fix bug in Kokkos occasional neighlist build
2020-04-28 10:51:34 -04:00
8f9323a3d7 Merge pull request #2013 from wverestek/master
small modification to fix bond/react to allow equal style variables as probability input
2020-04-28 10:51:07 -04:00
ad47b64cb9 Merge pull request #65 from junghans/collected-small-changes
GPU.cmake: localize hackery
2020-04-28 10:49:39 -04:00
ef3e071067 GPU.cmake: localize hackery 2020-04-28 07:43:31 -06:00
672d593241 Merge pull request #64 from junghans/collected-small-changes
cmake: reenable CMAKE_TUNE_FLAGS check
2020-04-28 08:50:37 -04:00
24fe5bc187 cmake: reenable CMAKE_TUNE_FLAGS check 2020-04-28 06:03:34 -06:00
6be36196da explicitly include STUBS MPI headers for serial compile since we seem to pick up the OpenMP ones otherwise 2020-04-28 01:36:21 -04:00
705c10ef47 restore original command 2020-04-28 01:12:49 -04:00
867088dbd8 add packages to also allow a regular build not just cross-compilation 2020-04-28 01:12:31 -04:00
d931365e4e fix typos 2020-04-28 01:11:54 -04:00
d3017744a9 updates for building with hip 2020-04-28 00:39:11 -04:00
25d1ad7714 update HIP compilation makefile for updated legacy build 2020-04-27 23:18:25 -04:00
b362a06ca3 (temporarily) disable CMAKE_TUNE_FLAGS verification script code 2020-04-27 23:17:43 -04:00
dd5ebb0a81 add preset to compile with hcc 2020-04-27 22:30:17 -04:00
29d667721a tweak GPU.cmake so that hip_get_devices compiles and links 2020-04-27 22:29:41 -04:00
5006c2c329 Merge branch 'latte_super_build' of github.com:junghans/lammps into collected-small-changes 2020-04-27 21:19:45 -04:00
0b93b45f2a Fix issues in dihedral_charmm_kokkos 2020-04-27 15:55:15 -06:00
c828492dee Merge branch 'collected-small-changes' of github.com:akohlmey/lammps into collected-small-changes 2020-04-27 17:18:59 -04:00
edd708dbce fix command ordering issues with gpu image build 2020-04-27 17:17:33 -04:00
76d7699abe remove trailing whitespace 2020-04-27 16:58:43 -04:00
74e8505a1f Merge branch 'master' into collected-small-changes 2020-04-27 16:57:47 -04:00
2dd737e765 Fix UVM compile issues 2020-04-27 14:47:03 -06:00
b38e95f88c Merge pull request #1895 from stanmoore1/kk_compute_orientorder_atom
Add Kokkos version of compute orientorder/atom
2020-04-27 16:34:29 -04:00