Commit Graph

39 Commits

Author SHA1 Message Date
0ce25755cd second round of include-what-you-use updates 2024-02-28 15:37:13 -05:00
78470febbd Merge branch 'develop' of github.com:lammps/lammps into kk_update_4.0 2023-07-14 17:59:15 -06:00
92c118b29f replace for (;;) with while (true) 2023-06-25 05:56:51 -04:00
d3b48a9346 kokkos: use std::enable_if_t and std::is_same_v 2023-04-22 16:20:04 -06:00
27da716852 getting out of the insurance business :-) 2023-01-23 16:45:41 -05:00
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
051c243cfc small programming style upgrade, apply clang-format, silence compiler warnings 2022-05-06 16:44:13 -04:00
6432660bc9 Merge branch 'develop' of https://github.com/lammps/lammps into coo_opt 2022-05-06 13:24:14 -06:00
54e667e491 convert more styles to use new neighbor list request API, apply clang-format 2022-03-05 21:44:45 -05:00
f05807f38e Revert 647380a 2021-11-01 14:34:50 -06:00
ae3e6e423a Fix loop level 2021-10-27 13:51:41 -06:00
2ca7dcb853 Use lighter construct than powint 2021-10-27 13:41:29 -06:00
647380a357 Avoid bitshift that gave incorrect results on GPU 2021-10-20 13:21:07 -06:00
d97e55d54a Precompute some sqrt factors 2021-10-15 11:53:54 -06:00
17316f92c7 Add optimized version of compute_orientorder_atom from Tomas Oppelstrup (LLNL) 2021-10-12 07:50:05 -07:00
3d86a0f5f6 Fix two bugs in compute_orientorder_atom_kokkos 2021-10-06 11:15:34 -07:00
09c19a936b update URLs in source code and manual 2021-05-24 14:18:20 -04:00
d1941392d3 disable clang-format for all existing .cpp files (for now) 2021-05-05 23:53:38 -04:00
5e55ab0e9b silence compiler warnings 2021-02-08 20:19:01 -05:00
51a20175c9 more code formatting consistency changes for loops and conditionals 2020-12-30 09:47:45 -05:00
382ade15fe more consistent formatting of for/while loops and if statements 2020-12-30 09:09:08 -05:00
72f68f3d56 consolidate multiple factorial() function definitions into MathSpecial::factorial() 2020-12-17 12:47:04 -05:00
adf74b3a22 use https://lammps.sandia.gov based URLs consistently 2020-10-21 16:45:30 -04:00
f67bd8eb5d more KOKKOS, USER-OMP, and USER-INTEL include file cleanup 2020-09-03 10:54:06 -04:00
6113169a47 IWYU based include statement cleanup 2020-09-02 17:39:34 -04:00
1939a9e665 silence a few more compiler warnings and remove dead code 2020-08-13 20:13:51 -04:00
4227c5e9e1 silence more compiler warnings about unused parameters and variables 2020-08-13 18:19:35 -04:00
ed566bf6af First set of changes for Kokkos HIP 2020-08-04 12:16:26 -05:00
641f924161 Port changes to Kokkos package 2020-06-19 14:44:13 -06:00
76d7699abe remove trailing whitespace 2020-04-27 16:58:43 -04:00
ee9757b155 Add missing copymode flag statement 2020-04-27 08:31:56 -06:00
5de6224bd3 Fix logic error 2020-04-27 08:14:19 -06:00
261b826cfc Remove Kokkos deprecated code 2020-04-24 12:49:50 -06:00
9c081cf439 Update from master 2020-04-24 12:18:53 -06:00
60bba3e238 Fix var name 2020-03-04 13:09:25 -07:00
72a9ce0f32 Add loop chunking option to compute_orientorder_atom_kokkos 2020-03-04 12:31:37 -07:00
c505058c5c Add flag for Kokkos computes 2020-02-24 15:43:29 -07:00
674781fe0e Add Kokkos version of compute orientorder/atom 2020-02-24 13:27:40 -07:00