Commit Graph

4586 Commits

Author SHA1 Message Date
a50c980595 Merge branch 'master' into pair-style-nnp 2021-05-24 12:08:45 -04:00
a0352433c0 Merge pull request #2777 from akohlmey/collected-small-changes
Collected small changes and fixes
2021-05-24 11:48:04 -04:00
08b44b59b0 Merge pull request #2776 from akohlmey/clang-tidy
Address issues detected by static code analysis with clang-tidy
2021-05-24 11:07:25 -04:00
0b538b1922 add tool to fix LAMMPS homepage URLs 2021-05-23 19:49:32 -04:00
7ba0d553e4 correct C++ standard dependency of Kokkos in Package details summary 2021-05-22 18:34:33 -04:00
01a94af217 small doc update / whitespace fix 2021-05-22 08:01:45 -04:00
10961b8cb6 update to upstream 2021-05-21 16:15:31 -04:00
e01502d349 Finished build doc pages 2021-05-21 18:18:46 +02:00
83a15ef03f fixing typos in documentation 2021-05-20 18:26:02 -06:00
5aebbee564 coordinate -> site 2021-05-19 19:29:00 -04:00
cfb3efb50f add cmake config option to enable clang-tidy with preferred options 2021-05-19 16:45:43 -04:00
a847a7ee9e print warning when a tip4p pair style may cause incorrect results 2021-05-19 15:33:26 -04:00
0c6857914d Adding example, misc patches 2021-05-18 20:57:24 -06:00
a0ca2e2681 Updated pair style hdnnp docs 2021-05-19 00:15:25 +02:00
32838fd4b8 Merge pull request #2773 from dynikon/master
Fix angle_style table doc
2021-05-18 16:31:15 -04:00
f61c27ca12 Updating gitignore 2021-05-18 14:07:23 -06:00
c6991b20ca fix angle_table doc 2021-05-18 13:26:13 +09:00
9cf8f96838 Fixed bug, changed build docs 2021-05-17 00:39:06 +02:00
31a55f1f76 Merge branch 'master' of github.com:lammps/lammps into pair-style-nnp 2021-05-16 22:54:29 +02:00
266b824b92 document -mdi command line flag 2021-05-15 22:30:14 -04:00
d8d1f398cd fix formatting issues 2021-05-15 18:12:16 -04:00
7d40eb3cac fix issue with commands docs not being kept separate from programmer guide 2021-05-15 00:26:19 -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
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
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