Commit Graph

7775 Commits

Author SHA1 Message Date
7d40eb3cac fix issue with commands docs not being kept separate from programmer guide 2021-05-15 00:26:19 -04:00
492d82904f add false positives 2021-05-14 23:51:43 -04:00
59cc481108 change config entry for post 3.5 sphinx versions and enable permalinks 2021-05-14 23:51:33 -04:00
9f4cca4981 correct index entries 2021-05-14 23:50:51 -04:00
c311574fe6 add missing fix entry 2021-05-14 23:50:38 -04:00
20de21f8de Merge branch 'master' into next_patch_release 2021-05-14 23:39:25 -04:00
7284a70900 Merge branch 'master' into prepare-clang-format 2021-05-14 17:25:24 -04:00
de025aec47 Merge pull request #2761 from rbberger/collected-small-changes
Collected small changes and fixes for the next patch release
2021-05-14 17:24:36 -04:00
9483db9581 Merge branch 'prepare-clang-format' of github.com:akohlmey/lammps into prepare-clang-format 2021-05-14 17:21:18 -04:00
6740959c65 Merge pull request #2611 from MolSSI-MDI/mdi
Add MolSSI Driver Interface Support
2021-05-14 13:18:52 -04:00
ad34953a52 Merge branch 'master' into collected-small-changes 2021-05-14 08:35:49 -04:00
e5cc4409a5 Merge pull request #2760 from jrgissing/bond/react-custom_constraint
Bond/react: custom constraint
2021-05-13 20:04:48 -04:00
6b275e283c step version number for the next patch release 2021-05-13 17:14:35 -04:00
242949100a describe use of clang-format when submitting contributions 2021-05-13 15:01:42 -04:00
30d2f18ccb whitespace fixes 2021-05-13 09:57:58 -04:00
33205ed91f Use "mdi/engine" consistenty, complete integration in manual, spelling 2021-05-13 09:57:08 -04:00
94b52d3bd1 Minor fixes to MDI documentation 2021-05-12 18:31:10 -04:00
2d12d04545 additions/changes to MDI doc pages 2021-05-12 18:31:10 -04:00
a731c43000 Add docs for mdi_engine command and fix 2021-05-12 18:31:10 -04:00
9a36acf96b Merge branch 'master' into collected-small-changes 2021-05-12 18:01:48 -04:00
058d56cf5c Merge pull request #2733 from stanmoore1/kk_update_3.4.0
Update Kokkos library in LAMMPS to v3.4.0
2021-05-12 17:00:44 -04:00
e960674cea Merge pull request #2536 from jtclemm/multi_epcc
Add faster method for multi neighboring
2021-05-12 15:25:28 -04:00
8617770592 Merge pull request #2511 from samueljmcameron/fix_bd_sphere
Add USER-BROWNIAN package
2021-05-12 13:51:42 -04:00
dfb15e76c3 Merge branch 'master' of https://github.com/lammps/lammps into kk_update_3.4.0 2021-05-12 08:14:03 -06:00
e3c9e9c328 document scalar output property of fix grem 2021-05-12 09:13:47 -04:00
9ef0395313 whitespace fixes 2021-05-12 06:30:52 -04:00
f0e52981f2 Merge branch 'master' into multi_epcc 2021-05-12 06:16:52 -04:00
71da854c38 small doc updates 2021-05-12 00:07:32 -04:00
5591b0f33d Merge branch 'master' into smooth-gpu 2021-05-11 23:59:14 -04:00
e874446b7c fix whitespace in doc files 2021-05-11 21:20:29 -04:00
ee546e2fa3 Merge pull request #2758 from akohlmey/collected-small-changes
Collected small changes and fixes for the next patch release
2021-05-11 19:31:12 -04:00
ed75618ad6 integrate USER-BROWNIAN package into the documentation proper 2021-05-11 18:31:59 -04:00
92c5951d6c Update to latest changes from upstream 2021-05-11 17:49:03 -04:00
5b8763c471 Merge branch 'lammps:master' into smooth-gpu 2021-05-11 22:22:33 +03:00
94a646cd01 new accelerator variant: GPU 2021-05-11 22:17:29 +03:00
c2ddce4c26 new accelerator variant: GPU 2021-05-11 22:13:37 +03:00
228711f59b add GPU device query functions to library interface and its wrappers 2021-05-11 14:59:49 -04:00
4213ebd2ff Merge branch 'lammps:master' into bond/react-custom_constraint 2021-05-11 12:54:46 -06:00
3173b39444 Update fix_bond_react.rst
restore original docs
2021-05-11 01:26:37 -04:00
3eef759bb1 Merge pull request #2749 from akohlmey/varargs-message-warning
Make warning and info messages vararg compatible and implement "thermo_modify warn"
2021-05-10 13:41:23 -04:00
0a1c2b2a23 update false positives 2021-05-09 23:11:20 -04:00
d70932bcdd add note about cases where the number of warnings can be larger than the limit 2021-05-07 19:46:25 -04:00
9d40f85919 address spelling issues 2021-05-07 18:46:01 -04:00
f43b7e0840 update and clarify documentation of thermo_modify warn 2021-05-07 18:42:45 -04:00
427a430b93 update list of default settings 2021-05-07 09:18:00 -04:00
b392b63224 clarify non-mixing behavior 2021-05-06 18:00:22 -04:00
7b9d721c08 fix typos 2021-05-06 18:00:11 -04:00
54884c978a Merge pull request #2742 from rbberger/offline_builds
Add tool to support offline builds
2021-05-05 23:54:55 -04:00
13fb03cf2c fix typo 2021-05-05 23:22:05 -04:00
bdbe773a08 add documentation for offline building scripts 2021-05-05 23:20:01 -04:00