2132b1d904
update developer reference text
2022-10-24 11:08:26 -04:00
cccf3f6f78
change email for contacting LAMMPS developers, add to homepage checker
2022-10-20 20:36:03 -04:00
86b686f159
correct handling of neighflag member variable in KOKKOS styles
2022-03-10 00:52:16 -05:00
3ef02edb48
adapt KOKKOS package styles to use new neighbor list request API
2022-03-09 22:43:38 -05:00
09c19a936b
update URLs in source code and manual
2021-05-24 14:18:20 -04:00
2f91b03c50
Small tweak
2021-05-17 09:52:50 -06:00
5271854721
Fix dellocation issues
2021-05-17 09:41:14 -06:00
07cb55ef7f
Merge branch 'master' into prepare-clang-format
2021-05-14 20:43:51 -04:00
117b6e2a80
Add copymode flag
2021-05-14 12:43:02 -06:00
7b4fdb92df
Use only copymode in Kokkos pair_styles
2021-05-14 09:36:13 -06:00
d1941392d3
disable clang-format for all existing .cpp files (for now)
2021-05-05 23:53:38 -04:00
ae3bcff4b6
Merge branch 'master' into collected-small-changes
2021-01-05 15:24:00 -05:00
382ade15fe
more consistent formatting of for/while loops and if statements
2020-12-30 09:09:08 -05:00
8efd1c93ec
Add more granular control of Kokkos pair and fix comm
2020-12-22 09:19:01 -07:00
adf74b3a22
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
f1ef7d85a8
T2345: Replace instances of NULL with nullptr
...
The following changes have been applied to src and lib folders:
regex replace: ([^"_])NULL ⇒ \1nullptr (8968 chgs in src, 1153 in lib)
Manually find/change: (void \*) nullptr ⇒ nullptr (1 case)
regex find: ".*?nullptr.*?"
Manually ~14 cases back to "NULL" in src, ~2 in lib
regex finds a few false positive where nullptr appears between two
strings in a function call
2020-09-12 09:34:38 -06:00
96d8d12a88
replace calls to force->*numeric() with the corresponding utils::*numeric()
...
this also removes the now obsolete functions from Force
2020-08-29 20:31:02 -04:00
08a5a05ece
reduce compiler warnings in KOKKOS version of USER-DPD code
2020-08-13 20:54:06 -04:00
ed566bf6af
First set of changes for Kokkos HIP
2020-08-04 12:16:26 -05:00
712b8668cb
Fix Kokkos neighlist issue and remove N2 option
2020-04-28 10:33:10 -06:00
7a5f73137a
Fix runtime issues with Kokkos vatom
2020-03-26 16:21:06 -06:00
e298978da0
Change Kokkos::Impl to std namespace
2020-03-25 13:58:12 -06:00
2b5a6d3b7f
clean up (some) includes in KOKKOS package
2019-07-15 18:05:20 -04:00
5b3a15bd94
putting implementation header first in package folder sources
2019-07-03 19:58:25 -04:00
06a57dd659
use ev_unset for all pair styles
2019-03-13 17:49:16 +01:00
f0e48931e4
Remove deprecated KOKKO_HAVE macros
2019-03-07 10:17:32 -07:00
ba693a74be
Add contribute method to pair_table_kokkos
2018-08-07 12:27:32 -06:00
e4071d7f46
replace C-style include files with their C++ equivalents
2018-04-27 18:00:24 -04:00
a6d10ba91d
Remove deprecated Kokkos code
2018-03-22 11:19:17 -06:00
a5998179bf
Fix issues with Kokkos skip lists
2018-01-15 08:23:39 -07:00
15a3364c2c
Make memory_kokkos its own class
2017-12-01 09:13:31 -07:00
1f6c1942b3
Disable allocation of per-atom arrays in ev_setup for Kokkos styles
2017-03-08 12:42:44 -07:00
daf9f95381
Fixing Kokkos per-atom e/v issue
2017-02-02 13:09:52 -07:00
53a1de1d40
fix several GPU memory bugs in pair_table_kokkos
2017-01-05 15:38:45 -07:00
d059b5d334
fix crash in create_kokkos_tables
...
the code was crashing when trying to
deep_copy or assign views that had
not been allocated
2017-01-05 15:38:45 -07:00
7cff343680
fix allocation regressions in PairTableKokkos
2017-01-05 15:38:45 -07:00
a1ac861084
PairTableKokkos : public PairTable
2017-01-05 15:38:45 -07:00
17bdb57bb4
try PairTableKokkos : public PairTable
...
realize that there is a lot of copy-paste
in this codebase.
2017-01-05 15:38:45 -07:00
8318c67816
Kokkos neighbor refactor
2016-12-07 13:00:27 -07:00
35753b8f08
add error location propagation to force->bounds() and force->boundsbig()
2016-10-26 15:53:02 -04:00
042f50ac9c
Christian's kokkos patch that allows concurrent host and device threading
...
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14752 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-03-18 14:50:28 +00:00
354e20f431
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14220 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-10-30 20:04:06 +00:00
ca4fa347b3
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13579 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-07-14 17:39:05 +00:00
4a975dd8cf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12957 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-01-19 23:49:20 +00:00
aeb7fec23a
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12814 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-12-02 02:15:39 +00:00
d9f92faf40
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12365 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-08-27 16:17:57 +00:00
3545d44d0d
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12040 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-05-29 22:51:58 +00:00
