Commit Graph

3892 Commits

Author SHA1 Message Date
b88cdd6890 Corrected implementation of ellipsoidal dynamics, made ashared base class for the time-integrators, templated the time-integrators (and so reversed changes that this PR had previously made to random_mars src files), combined docs of all three integrators. 2021-04-30 16:30:04 +01:00
a9ff9312d6 Merge remote-tracking branch 'origin/master' into varargs-log-error-functions 2021-04-28 18:13:31 -04:00
d315105dfa document line length limit in atomfile variable names 2021-04-27 18:43:23 -04:00
632e963092 add comment to line length truncation limit in data files 2021-04-27 18:39:43 -04:00
7b1b57aa9b rename utils::fgets_trunc_nl() to utils::fgets_trunc() 2021-04-27 18:32:51 -04:00
f29744b5bc add documentation for fgets_trunc_nl() 2021-04-27 16:21:17 -04:00
41c784a8a8 Update Build_extras 2021-04-26 20:51:35 -06:00
6b04ebd617 Merge branch 'master' into varargs-log-error-functions 2021-04-26 13:27:58 -04:00
b0cd6b3ef7 improve docs also for related functions 2021-04-24 22:08:28 -04:00
8e5e995188 add docs for new utility function 2021-04-24 21:32:29 -04:00
8fc9eb26bc address spell checker warnings 2021-04-23 15:08:20 -04:00
49b540381c Merge branch 'master' into dpd_extended 2021-04-23 15:03:03 -04:00
a9abcadc01 one more doc fix 2021-04-23 20:09:41 +02:00
e28867eed0 change doc 2021-04-23 20:08:56 +02:00
3ac2b36993 add link to Commands_pair.rst 2021-04-23 16:10:00 +02:00
25c0bb7a31 Merge branch 'master' into examples 2021-04-22 18:08:32 +02:00
e7cb20efeb replace non-ASCII character in docs 2021-04-21 23:55:40 -04:00
3aec5c6484 tweak docs for logmesg() overload 2021-04-21 23:50:13 -04:00
6ceeee24e2 Merge branch 'master' into collected-small-changes 2021-04-21 21:59:58 -04:00
7e2d40c5fa Merge pull request #2642 from rbberger/balance_tests
MPI balancing testing
2021-04-21 16:00:01 -04:00
1c80c9455b whitespace fixes 2021-04-21 14:58:57 -04:00
a64a7d5096 Merge pull request #2714 from julient31/STT2
Improvement of the SPIN package by removing a limitation
2021-04-21 14:55:17 -04:00
b1dd616a2f correcting a small typo in the checks, and adding a note in the
documentation of fix precession/spin about the error if a (0,0,0) vector
is given as an input.
2021-04-21 07:43:00 -06:00
58549fa10d Merge branch 'clean-master2' of github.com:julient31/lammps into STT2 2021-04-19 17:32:16 -06:00
10ea64fb0c Improving the doc for the STT term 2021-04-19 17:25:14 -06:00
f2096ded96 - improved design of test_problem
- cleaned up langevin/spin
- started doc for stt and hexaniso
2021-04-19 17:09:53 -06:00
58292e5c51 Merge branch 'master' into examples 2021-04-19 19:31:42 +02:00
cf62dbf96a In manual pages point to examples 2021-04-19 18:23:33 +02:00
1ad45d65d6 document limitation of not using GPU pair styles as the same style multiple times with hybrid 2021-04-19 08:09:02 -04:00
668b74bc09 Merge branch 'master' into spin-kokkos 2021-04-16 17:08:38 -04:00
4ed57cb757 Merge pull request #2705 from akohlmey/collected-small-changes
Collected small changes and fixes
2021-04-16 17:07:39 -04:00
ce51305b2d fix typing error in doc file 2021-04-16 15:44:20 +02:00
f115b8ba2f Merge branch 'master' into dpd_extended 2021-04-16 14:16:53 +02:00
9031c23080 add extended dpd (dpdext & dpdext_tstat) 2021-04-16 14:14:18 +02:00
024725c3e0 notation update
constraints can be grouped logically with curly brackets now, instead of parentheses
2021-04-15 16:19:09 -04:00
21a38c203a bond/react: custom constraint docs 2021-04-15 16:11:39 -04:00
75579fc100 take advantage of having the common Command base class to unify code paths 2021-04-14 07:05:00 -04:00
81578d9934 update docs for change in class topology 2021-04-13 17:47:21 -04:00
d8c68dec6f whitespace fixes 2021-04-12 23:32:26 -04:00
014875fb1e Merge branch 'master' into collected-small-changes 2021-04-12 23:28:43 -04:00
f07fa3d266 Merge pull request #2704 from rbberger/compress_package
More refactoring of COMPRESS package
2021-04-12 23:01:35 -04:00
9bc353e5bd Merge pull request #2585 from tc387/charge_regulation2
Add fix charge/regulation to MC package
2021-04-12 18:49:03 -04:00
0ca9f2e8a0 Merge pull request #2699 from yury-lysogorskiy/feature/user-pace
USER-PACE pair_style integration into LAMMPS
2021-04-12 17:05:40 -04:00
bdfa45376d Merge branch 'master' into collected-small-changes 2021-04-12 14:59:42 -04:00
04248c2ccd finalize CMake build docs 2021-04-12 14:52:35 -04:00
3925bcc1de apply requested changes do pair style hybrid doc 2021-04-12 13:41:38 -04:00
9658b8e645 move fix charge/regulation to MC package (examples stay in place for now) 2021-04-12 10:05:52 -04:00
bc25fa8268 full integration into documentation build system 2021-04-12 09:59:02 -04:00
e95cbf618b Merge branch 'master' into charge_regulation2 2021-04-12 09:55:15 -04:00
39a00e2901 reformat 2021-04-11 06:03:46 -04:00