Commit Graph

634 Commits

Author SHA1 Message Date
94a95b56e6 Merge remote-tracking branch 'github/develop' into collected-small-changes 2024-04-16 22:42:48 -04:00
329d546eea Merge pull request #4078 from jmgoff/pace-mliap
Update ML-IAP for ACE support
2024-04-16 22:42:17 -04:00
27266e72c4 Merge pull request #3984 from lammps/general-triclinic
Add suppport for general triclinic simulation boxes and systems
2024-04-16 21:04:59 -04:00
89d98786ec small doc formatting and spelling fixes 2024-04-16 19:33:14 -04:00
1924a06466 Merge branch 'develop' into collected-small-changes
# Conflicts:
#	python/lammps/pylammps.py
2024-04-15 17:21:38 -04:00
17d04ce41a Merge remote-tracking branch 'github/develop' into restricted-angle 2024-04-13 02:45:53 -04:00
f557dfdebb mention typelabel paper 2024-04-11 23:36:11 -04:00
e979e8dc01 spelling add false positives 2024-04-09 22:36:49 -04:00
972d412186 flag false positives 2024-04-03 20:53:44 -04:00
ed0cff92de Merge remote-tracking branch 'github/develop' into general-triclinic 2024-04-02 09:41:21 -04:00
b712e46497 doc fixes 2024-03-29 21:00:51 -04:00
d97c7fffac spelling 2024-03-17 15:13:13 -04:00
01d412bdbf Merge branch 'develop' into general-triclinic 2024-03-08 21:32:01 -05:00
35db949e77 Merge pull request #4069 from vladgl/fix_wall_flow
New fix implementing flow boundary conditions
2024-02-26 12:46:20 -05:00
66701ef1e2 complete rebomos docs 2024-02-23 17:29:31 -05:00
49886caaf1 add OPENMP package version of pair style rebomos 2024-02-22 15:17:46 -05:00
71e0d506e7 spelling 2024-02-22 04:56:27 -05:00
0f5436de99 Fix spelling 2024-02-07 13:55:27 +03:00
dbdcfc5c97 Merge branch 'develop' into general-triclinic
# Conflicts:
#	src/atom.cpp
2024-02-06 19:21:50 -05:00
0bb6be5dd9 provide a more detailed description of the bundled tests 2024-02-06 11:37:41 -05:00
7905e5d146 Merge branch 'develop' into general-triclinic
# Conflicts:
#	src/atom.cpp
2024-01-29 21:05:21 -05:00
40782fec09 fix spelling issues 2024-01-26 14:55:09 -05:00
8cf2705d68 Merge branch 'develop' into general-triclinic 2024-01-18 15:01:09 -05:00
f78f596d9d document using enumerator constants in Atom and AtomVec classes 2024-01-17 14:58:09 -05:00
c6d1cbef5a Merge branch 'develop' into general-triclinic 2024-01-04 21:10:50 -05:00
41495579a6 update list 2023-12-16 00:18:05 -05:00
1e0d0e327c Merge pull request #4004 from akohlmey/collected-small-changes
Collected small changes and updates
2023-12-13 16:25:16 -05:00
e7c330db9d Merge branch 'develop' into snann_slcsa 2023-12-12 22:30:20 -05:00
6923c04e47 spelling and formatting fixes. small clarifications 2023-12-12 21:01:20 -05:00
dd6b77d570 Merge branch 'develop' into general-triclinic 2023-12-06 07:01:55 -05:00
9c103ff6e2 fix some accumulated formatting and spelling issues in the manual 2023-12-06 02:59:47 -05:00
30051ec260 Merge pull request #3858 from jtclemm/new-computes
Adding tools to identify rattlers and measure nonaffine displacement
2023-12-06 02:51:21 -05:00
28c547a3cf Merge branch 'develop' into general-triclinic 2023-12-02 12:40:23 -05:00
acdb0481f0 loads of spelling fixes 2023-12-01 15:54:54 -05:00
f6b644388c add moltemplate tutorial to HowTo section 2023-11-30 16:41:19 -05:00
fe418bbe77 spelling 2023-11-29 02:11:54 -05:00
dc3b6aa697 Minor edits, mainly affecting friction keyword 2023-10-06 16:47:38 -06:00
c2eafb874d update docs for LAMMPS GUI v1.4 2023-08-30 04:38:11 -04:00
c71c4d0fcd must have a verbatim block to include .. versionadded:: 2023-08-28 21:19:04 -04:00
2c897df841 Merge branch 'develop' into new-computes 2023-08-24 09:38:05 -04:00
f5361b49be Merge branch 'develop' into new-computes 2023-08-18 06:58:14 -04:00
67f42fa84f add version tags, sort out spelling issues 2023-08-18 06:58:00 -04:00
5528cefe0f move fsaa keyword next to ssao and away from dump_modify
we don't need to reallocate the buffers this way
2023-08-17 19:57:46 -04:00
185fa1bcdb small documentation and spelling updates 2023-08-15 12:01:07 -04:00
9f407cae1e more documentation and tutorial updates 2023-08-13 02:57:02 -04:00
b6f7a27b09 Merge pull request #3871 from megmcca/local-composition
Per-atom compute to calculate local composition of atom types
2023-08-05 00:53:57 -04:00
376b83df52 Merge branch 'develop' of github.com:lammps/lammps into local-composition 2023-08-04 13:23:53 -06:00
2305c4cb30 Merge branch 'develop' into cmake-3.16 2023-08-03 17:39:15 -04:00
6b50daf5b7 Merge branch 'collected-small-fixes' into lammps-gui
# Conflicts:
#	cmake/CMakeLists.txt
2023-08-01 03:07:56 -04:00
72ea2673dd update LAMMPS manual and README file 2023-07-31 00:07:32 -04:00