06a9fda7a4
Merge pull request #1966 from rbberger/library-interface-update
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Allow query of available styles from lib interface
2020-03-27 17:54:46 -04:00
89eb5fc65a
cmake: fix build for shared libs
2020-03-27 15:35:05 -06:00
c49310721c
Hide secret styles
2020-03-27 17:23:09 -04:00
055764c20a
cmake: install exceptions.h as well
2020-03-27 15:20:10 -06:00
686a2c7a43
Support host execution
2020-03-27 15:19:40 -06:00
16ac65e8cf
cmake: make mpi public again
2020-03-27 15:01:51 -06:00
3b1244831e
Add Python::has_minimum_version
2020-03-27 16:28:43 -04:00
6f8915e0a5
cmake: updated COUPLE/simple cmake
2020-03-27 13:55:34 -06:00
1861c0f8ec
Fix deprecated Kokkos code issue
2020-03-27 12:20:13 -06:00
e809bf6566
Fix merge issue
2020-03-27 11:08:20 -06:00
f7cfaec57d
Fix team_size issue in comm_kokkos
2020-03-27 10:18:33 -06:00
758c812306
Allow query of available styles from lib interface
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Adds the following new library functions:
- lammps_has_style()
- lammps_style_count()
- lammps_stlye_name()
The Info class now also has the following member functions:
- Info::has_style()
- Info::get_available_styles()
2020-03-26 22:45:18 -04:00
6b6dd07414
Fix runtime issues with pair_exp6_rx_kokkos
2020-03-26 17:12:08 -06:00
7a5f73137a
Fix runtime issues with Kokkos vatom
2020-03-26 16:21:06 -06:00
b54697efb8
Fix runtime issue in atom_vec_sphere_kokko
2020-03-26 15:56:58 -06:00
5c0f027464
Fix team_size issue in comm_kokkos
2020-03-26 15:32:45 -06:00
f6a107c448
Fix team_size issues in pair_snap_kokkos
2020-03-26 15:29:01 -06:00
e88e8bdabe
cmake: improve install of support libs
2020-03-26 15:00:46 -06:00
8456f3f2ec
MEAM/C: refactor file reading with MPI, scope locals accordingly
2020-03-26 17:20:23 +01:00
9e0e046eb2
MEAM/C: improve error messages and documentation
2020-03-26 17:20:23 +01:00
e601fa4e8d
cmake: add example CMakeLists.txt for xamples/COUPLE/simple
2020-03-26 08:42:00 -06:00
897f5b19be
cmake: improve exported target a bit
2020-03-26 08:41:05 -06:00
be93ef7b20
update
2020-03-25 22:53:58 -04:00
25199e0e57
update
2020-03-25 22:37:26 -04:00
09097e14b9
update
2020-03-25 22:35:55 -04:00
4f0540b331
update
2020-03-25 22:24:26 -04:00
73b8c5ec6b
USER-PLUMED.cmake: fix fftw3 linkage
2020-03-25 19:46:10 -06:00
a08cf6d609
cmake: mpi_stubs needs to be public
2020-03-25 19:41:34 -06:00
9c51bb6cb3
Merge pull request #4 from lammps/master
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update
2020-03-25 21:25:33 -04:00
b60acaa657
MESSAGE.cmake: fix up
2020-03-25 19:19:00 -06:00
01a51d655c
cmake: move kokkos to external project (part I)
2020-03-25 19:11:49 -06:00
9ac445005b
Merge pull request #3 from lammps/master
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update
2020-03-25 21:10:27 -04:00
c05e1871bf
style issues
2020-03-25 20:26:39 -04:00
fa4ef70829
code issues
2020-03-25 20:18:07 -04:00
af6849f783
cmake: fix up MESSAGE.cmake
2020-03-25 18:10:52 -06:00
761de9b13c
cmake: add more libs to export target
2020-03-25 18:05:36 -06:00
cad6332065
cmake: add gpu to export target
2020-03-25 18:01:01 -06:00
ad731869d7
cmake: fix atc compile
2020-03-25 16:18:19 -06:00
36b826348b
Fix compile issues with Kokkos
2020-03-25 16:12:37 -06:00
568aaeca22
cmake: needs mpi
2020-03-25 15:04:20 -06:00
1e59101606
cmake: fix exported target
2020-03-25 14:52:27 -06:00
ad37c0a806
USER-SMD.cmake: fix a typo
2020-03-25 14:42:23 -06:00
50935b5cbc
Fix typos
2020-03-25 14:23:45 -06:00
60864e38d1
Update Kokkos library in LAMMPS to v3.0
2020-03-25 14:08:39 -06:00
0252d8c210
Fix compile for UVM
2020-03-25 13:58:20 -06:00
e298978da0
Change Kokkos::Impl to std namespace
2020-03-25 13:58:12 -06:00
0025dfe1e3
Update Kokkos CUDA minimum verison
2020-03-25 13:56:18 -06:00
1e7e9369da
Fix runtime error in Kokkos package
2020-03-25 13:56:07 -06:00
4eebcdfc0d
Fix runtime issue in Kokkos
2020-03-25 13:55:51 -06:00
7a09636f9a
Fix compile issue in pair_kokkos.h
2020-03-25 13:55:40 -06:00
