|
|
d11733d3a0
|
typo in equation
|
2017-09-28 18:28:46 +02:00 |
|
|
|
348c4eb7f3
|
add .cpp and .h to root src
|
2017-09-28 18:18:28 +02:00 |
|
|
|
75b3f34a58
|
Update documentation
|
2017-09-28 18:16:06 +02:00 |
|
|
|
fe80c57bde
|
more documentation
|
2017-09-28 17:01:12 +02:00 |
|
|
|
e49f0e396b
|
Create fix_rhok.txt
|
2017-09-28 16:24:26 +02:00 |
|
|
|
37e55a825b
|
Create fix_rhok.txt
|
2017-09-28 16:20:03 +02:00 |
|
|
|
67e48264d9
|
Update fix_rhok.cpp
|
2017-09-28 16:02:20 +02:00 |
|
|
|
4e1eeca869
|
Update fix_rhok.cpp
|
2017-09-28 16:02:00 +02:00 |
|
|
|
2fda041972
|
Update fix_rhok.cpp
|
2017-09-28 16:00:16 +02:00 |
|
|
|
34c1adb4dd
|
Merge https://github.com/lammps/lammps
|
2017-09-28 12:28:58 +02:00 |
|
|
|
23e283f135
|
Fixed proper deletion of fixes if fix is NULL
|
2017-09-27 16:20:07 +02:00 |
|
|
|
de45fa6e71
|
correct bogus links in LATTE docs
|
2017-09-26 18:25:37 -04:00 |
|
|
|
bfdc4acb8b
|
add missing entry for pdf version of manual
|
2017-09-26 16:53:36 -04:00 |
|
|
|
fd3ecd0481
|
fix typo in formatting
|
2017-09-26 16:52:24 -04:00 |
|
|
|
8bba6d3e8c
|
correct formatting and broken/colliding link issues with LATTE package related documentation
|
2017-09-26 16:52:10 -04:00 |
|
|
|
53e4ee4f2d
|
need to re-init timers after initial setup
|
2017-09-25 23:20:42 -04:00 |
|
|
|
b60cff7e77
|
USER-OMP package depends on USER-DRUDE
|
2017-09-25 23:15:49 -04:00 |
|
|
|
38530415c8
|
-ltbbmalloc is required
|
2017-09-25 20:03:53 -04:00 |
|
|
|
0573aaa6da
|
update src/.gitignore for LATTE package
|
2017-09-25 19:37:55 -04:00 |
|
|
|
e6969002ce
|
having plain filelink instead of filelink.o confuses KOKKOS linking with nvcc
|
2017-09-25 19:37:37 -04:00 |
|
|
|
0448bc9caf
|
Merged stuff.
|
2017-09-25 18:31:32 -04:00 |
|
|
|
836a6d292c
|
whitespace fixes, silence compiler warning about too few format specifiers
|
2017-09-25 16:31:39 -04:00 |
|
|
|
32e0de7a67
|
first pass at implementing atom2bin for KOKKOS neighbor lists
|
2017-09-25 14:06:20 -05:00 |
|
|
|
789812ec3d
|
KOKKOS: minor typo fix
|
2017-09-25 14:06:20 -05:00 |
|
|
|
88a882b457
|
Added reference to fix rhok implimentation
|
2017-09-25 18:59:23 +02:00 |
|
|
|
f1aea57e30
|
Update readme.md
|
2017-09-25 18:48:21 +02:00 |
|
|
|
b35f2ff8b4
|
Example of Interface Pinning Computation
|
2017-09-25 18:44:24 +02:00 |
|
|
|
4beccf508f
|
Move fix to USER-MISH
|
2017-09-25 18:35:53 +02:00 |
|
|
|
78a486c0fd
|
Authorize hybrid/overlay for fix srp
|
2017-09-25 16:18:08 +02:00 |
|
|
|
f2c1172741
|
patch 22Sep17
patch_22Sep2017
|
2017-09-22 15:46:34 -06:00 |
|
|
|
d6316c40d9
|
cmake: fix build with system latte
|
2017-09-22 15:36:14 -06:00 |
|
|
|
bcde318ccb
|
Merge pull request #659 from stanmoore1/kk_border_comm
Enhance Kokkos communication logic
|
2017-09-22 13:47:44 -06:00 |
|
|
|
3ed39ca844
|
Make Kokkos comm give warning and switch to classic comm instead of erroring out
|
2017-09-22 13:03:24 -06:00 |
|
|
|
ee487ef4aa
|
Merge pull request #652 from junghans/latte
Add LATTE fix
|
2017-09-22 10:32:19 -06:00 |
|
|
|
a8ae886667
|
update fix latte examples and virial
|
2017-09-21 10:40:54 -06:00 |
|
|
|
fe8244c1c2
|
Rename fix
|
2017-09-21 16:49:46 +02:00 |
|
|
|
3381a43378
|
Added readme.m
|
2017-09-21 16:20:06 +02:00 |
|
|
|
73708b091c
|
Added readme file, and removed old files
|
2017-09-21 16:17:26 +02:00 |
|
|
|
9a9af2ca5e
|
Delete README
|
2017-09-21 13:58:51 +02:00 |
|
|
|
491d5f3410
|
Added USER-PINNING package
|
2017-09-21 11:38:59 +02:00 |
|
|
|
5e35ab251b
|
fixed sucrose
|
2017-09-20 17:11:49 -06:00 |
|
|
|
d708e34ba6
|
cmake: download/build latte if not found
|
2017-09-20 12:01:26 -06:00 |
|
|
|
638b91bf74
|
Merge pull request #657 from lammps/snap-potentials
new SNAP potentials and examples
|
2017-09-20 09:34:51 -06:00 |
|
|
|
ad25a95297
|
whitespace cleanup
|
2017-09-20 11:13:13 -04:00 |
|
|
|
e7d042ba1a
|
convert DOS/Windows CR-LF line endings to native format
|
2017-09-20 11:12:58 -04:00 |
|
|
|
dd49d54889
|
new SNAP potentials and examples
|
2017-09-20 08:54:30 -06:00 |
|
|
|
fbaa7ab8fa
|
Merge pull request #655 from akohlmey/fixes-for-patch
collected small bugfixes for the next patch release
|
2017-09-20 08:51:47 -06:00 |
|
|
|
2e9803efb3
|
Merge pull request #645 from akohlmey/kokkos-makefile-updates
Some small kokkos makefile updates
|
2017-09-20 08:40:20 -06:00 |
|
|
|
59d2e13d48
|
add .gitignore and add Makefile.lammps.* symlinks to stay consistent with other libraries
|
2017-09-19 19:06:02 -04:00 |
|
|
|
76d93f21dd
|
add fix latte command to doc pages
|
2017-09-19 16:55:08 -06:00 |
|