|
|
d5aa60dbfe
|
skip inline function optimizations for windows when compiling with mingw
|
2019-04-01 17:23:27 -04:00 |
|
|
|
b7aecc0d59
|
avoid linking with -ldl on windows, as it is not needed or supported
|
2019-04-01 17:22:53 -04:00 |
|
|
|
2e7316a9e3
|
fix another windows portability issue in USER-PTM by adding missing header include
|
2019-04-01 08:11:22 -04:00 |
|
|
|
7688ead60f
|
add pair style granular to pair style overview page in manual
|
2019-04-01 04:42:56 -04:00 |
|
|
|
971bce7428
|
address formatting issue in pair granular docs
|
2019-03-30 23:33:54 -04:00 |
|
|
|
5065350081
|
improve kim-query documentation
|
2019-03-30 23:19:31 -04:00 |
|
|
|
74489621c4
|
correct misleading indentation to follow syntax
|
2019-03-30 22:35:41 -04:00 |
|
|
|
585403d650
|
Merge pull request #1397 from ellio167/kim-api-fix-1396
Rename FindKIM-API.cmake.in to FindKIM-API.cmake
|
2019-03-30 22:00:17 -04:00 |
|
|
|
a28ae7c2c0
|
Rename FindKIM-API.cmake.in to FindKIM-API.cmake
Fixes: #1396
|
2019-03-30 13:56:02 -05:00 |
|
|
|
560ccb2719
|
Merge pull request #1387 from akohlmey/next-patch-release
Step version string for next patch release
patch_29Mar2019
|
2019-03-29 14:25:45 -04:00 |
|
|
|
dd22b80a9d
|
Merge pull request #1393 from akohlmey/collected-small-changes
Collected small changes
|
2019-03-29 13:57:07 -04:00 |
|
|
|
ff7f129a5d
|
remove trailing whitespace
|
2019-03-29 11:37:26 -04:00 |
|
|
|
17cd650622
|
Merge branch 'master' into collected-small-changes
|
2019-03-29 11:35:15 -04:00 |
|
|
|
4eafb624b7
|
Merge pull request #1392 from ellio167/kim-2.0.2
Updates for kim-api-2.0.2 release
|
2019-03-29 11:31:00 -04:00 |
|
|
|
677753731f
|
Merge pull request #1395 from vishalkenchan/fix_unset_variable
Set Coulomb summation cutoff radii when it is explicitly specified
|
2019-03-29 10:37:29 -04:00 |
|
|
|
30929d95e2
|
Merge pull request #1342 from dsbolin/gran_mods
New generalized granular pair style added
|
2019-03-29 10:37:07 -04:00 |
|
|
|
75382cf265
|
update documentation tweaks to run cleanly
|
2019-03-29 10:34:34 -04:00 |
|
|
|
ff819be807
|
more 'war on tabs'
|
2019-03-29 10:21:44 -04:00 |
|
|
|
13255d6338
|
step version to 29 March 2019
|
2019-03-29 09:20:33 -04:00 |
|
|
|
6a60dad2c3
|
Set Coulomb summation cutoff radii in the case it is explicitly specified.
|
2019-03-29 10:02:15 +01:00 |
|
|
|
1bf5047c7a
|
document new CUDA_MPS_SUPPORT option in CMake
|
2019-03-28 18:03:54 -04:00 |
|
|
|
747ddf2642
|
expose -DCUDA_PROXY define to CMake so that the GPU package can be used with nvidia MPS proxy server
|
2019-03-28 17:15:05 -04:00 |
|
|
|
9d0e518cc5
|
Updates for kim-api-2.0.2 release
|
2019-03-28 15:35:22 -05:00 |
|
|
|
088a672196
|
replace (evil) tabs with (nice) spaces
|
2019-03-28 16:20:57 -04:00 |
|
|
|
30bca9f91e
|
force loading of Sphinx version 1.7.6 instead of 2.0.0 or later, so the spellchecker keeps working
|
2019-03-28 16:20:19 -04:00 |
|
|
|
93f531441a
|
Merge pull request #1388 from lammps/tiled-bug
bug fix for tiled communication at cutoffs near box size
|
2019-03-28 13:45:41 -04:00 |
|
|
|
d71d12d2de
|
Merge pull request #1391 from akohlmey/more-small-changes
Error out when per-atom stress is requested for USER-INTEL styles
|
2019-03-28 13:45:10 -04:00 |
|
|
|
74bfd78b06
|
Merge pull request #1390 from ckadding/master
Fix typos in argument checking for compute pressure/cylinder
|
2019-03-28 13:44:53 -04:00 |
|
|
|
4aff7191e7
|
small whitespace cleanup
|
2019-03-28 13:02:14 -04:00 |
|
|
|
eab939af23
|
add a note about the lack of stress/atom in USER-INTEL to the manual
|
2019-03-28 12:47:06 -04:00 |
|
|
|
16f66dc561
|
error out when per-atom stress is requested for bonded interactions with USER-INTEL
|
2019-03-28 12:38:41 -04:00 |
|
|
|
61483da58b
|
error out when per-atom stress is requested
|
2019-03-28 12:25:40 -04:00 |
|
|
|
ab12a7c95b
|
use consistent constants from math_const.h and fast integer powers from math_special
|
2019-03-28 11:58:04 -04:00 |
|
|
|
196b8c6eab
|
Fix typos in error checking
|
2019-03-28 11:53:32 -04:00 |
|
|
|
b9bddd7ba6
|
use ev_init() and add some more cosmetic changes to pair granular
|
2019-03-28 11:47:41 -04:00 |
|
|
|
2fa6e913ef
|
Merge branch 'master' into gran_mods
|
2019-03-28 11:46:44 -04:00 |
|
|
|
3cc740b9d3
|
handle granular specific pair style flags consistently and make sure they are never accessed uninitialized
|
2019-03-28 11:46:04 -04:00 |
|
|
|
03ee03c043
|
remove set but unused flag
|
2019-03-28 11:44:50 -04:00 |
|
|
|
5d7c52e114
|
clean up whitespace issues caused by commit 5210c4c3a4
|
2019-03-28 11:23:37 -04:00 |
|
|
|
5210c4c3a4
|
cosmetic reformatting of new GRANULAR files
|
2019-03-27 16:58:14 -06:00 |
|
|
|
6b09f6d490
|
bug fix for tiled communication at cutoffs near box size
|
2019-03-27 15:51:10 -06:00 |
|
|
|
28a6dcd1c3
|
Merge pull request #1384 from lammps/rendezvous2
second attempt at adding rendezvous protocol for some to some communication.
|
2019-03-27 17:44:16 -04:00 |
|
|
|
2ad9355140
|
Merge pull request #1383 from akohlmey/final-changes-for-patch
Several small changes and tweaks for patch release
|
2019-03-27 17:00:56 -04:00 |
|
|
|
e63d2cee87
|
Merge pull request #1375 from akohlmey/install-python-for-cmake
Refactor python module installer and add install-python target to CMake
|
2019-03-27 16:47:25 -04:00 |
|
|
|
b685a0a7b8
|
need to use fabs() when computing deltas when checking image flags for consistency
|
2019-03-27 15:47:14 -04:00 |
|
|
|
c4fd658e9d
|
rename micelle-rigid to micelle.rigid
|
2019-03-27 11:07:14 -04:00 |
|
|
|
8a384df5c3
|
use utils::strmatch() instead of strncmp()
|
2019-03-27 06:19:42 -04:00 |
|
|
|
8ba1d76055
|
some dead code removal and more whitespace cleanup
|
2019-03-27 05:38:41 -04:00 |
|
|
|
af8f06141f
|
Step version string for next patch release
|
2019-03-26 23:02:07 -04:00 |
|
|
|
03e86c4d17
|
update python module installation instructions
|
2019-03-26 22:49:21 -04:00 |
|
