Commit Graph

7403 Commits

Author SHA1 Message Date
d64be895e6 Allow for output of effective electronegativities 2024-09-26 16:42:01 +01:00
15e513958e clarification of min/max keywords in fix gcmc 2024-09-26 11:08:59 -04:00
385a0da892 update and correct description of running LAMMPS on Windows 2024-09-25 12:29:26 -04:00
b9600c5a67 Merge remote-tracking branch 'github/develop' into collected-small-changes 2024-09-23 14:50:45 -04:00
d787ecdcb3 clarify docs for XYZ file format 2024-09-23 14:44:16 -04:00
cfe96064e8 Fixing errors in RHEO doc files 2024-09-23 12:39:16 -06:00
b95f7c2ab2 Merge pull request #4333 from evoyiatzis/patch-4
add extract() function to several angle styles
2024-09-23 14:27:47 -04:00
061c80104a add docs to mention using a type labels for xyz files with string labels 2024-09-21 12:24:41 -04:00
8294bea7a7 Update angle section of fix_adapt.rst 2024-09-21 10:02:06 +02:00
5290779554 Merge branch 'develop' into collected-small-changes 2024-09-21 00:01:28 -04:00
d8c0691684 Update bond section of fix_adapt.rst 2024-09-20 19:55:07 +02:00
11838801d6 add extract() function to angle style cosine/squared 2024-09-19 07:21:15 -04:00
b1eefe71c7 add extract() method to bond style harmonic/shift/cut 2024-09-19 04:53:04 -04:00
4eb1b1f606 clarify docs 2024-09-18 23:14:27 -04:00
d909b205c7 update docs for building the RHEO package 2024-09-18 20:14:43 -04:00
6503f297d4 support angle style hybrid with fix adapt 2024-09-16 21:21:20 -04:00
516d988deb update fix adapt docs 2024-09-16 20:59:04 -04:00
4d55c53c10 update rst kk 2024-09-14 21:01:06 -04:00
fe8611bfc8 sync author info with LAMMPS home page 2024-09-13 22:55:05 -04:00
3f232caf9b Fix whitespace 2024-09-13 17:13:59 +01:00
af6efcc514 Add fix qtpie/reaxff documentation 2024-09-13 16:43:13 +01:00
92bd9fc161 fix linking a URL and fix spelling 2024-09-13 02:20:26 -04:00
9339da075b Merge pull request #4299 from evoyiatzis/patch-3
Allow the definition of point in region plane using variables
2024-09-12 17:52:30 -04:00
18f1d32f8e Apply suggestions from code review
Co-authored-by: Axel Kohlmeyer <akohlmey@gmail.com>
2024-09-12 09:00:55 -06:00
5a12c762f3 Merge branch 'develop' into ctip 2024-09-11 23:36:16 -04:00
6b2a47d9c6 fix typo 2024-09-11 06:34:15 -04:00
94e3351e4f Merge pull request #4308 from lammps/quick-regression
Add a quick and full regression test as GitHub Actions
2024-09-10 23:28:49 -04:00
88ceae303f documentation integration and version tags 2024-09-10 21:41:20 -04:00
68e134773c move pair style and fix whitespace 2024-09-09 20:58:01 -04:00
48689d1925 Merge branch 'develop' into ctip 2024-09-09 20:46:09 -04:00
4e8e84a1e4 Merge branch 'lammps:develop' into alphataubio-kokkos-fixes 2024-09-08 13:48:43 -04:00
6b68656a74 fix a typo 2024-09-07 09:06:22 -05:00
93b4e91801 update docs and add ref 2024-09-06 20:51:56 -04:00
bca271a286 mention regression tester in Build_development 2024-09-06 17:34:35 -05:00
b09e88a179 Merge pull request #4314 from akohlmey/collected-small-changes
Collected small changes and fixes
2024-09-06 16:24:31 -04:00
842896040d Merge branch 'develop' into aurora_updates, resolve merge conflicts 2024-09-06 11:20:29 -04:00
360fdabc19 small clarification 2024-09-05 23:05:25 -04:00
d67e0e6a41 consolidate spelling 2024-09-05 21:47:35 -04:00
03631aab00 whitespace and spelling fixes 2024-09-05 21:46:32 -04:00
e3ced6d26f docs 2024-09-04 23:44:44 -05:00
ee602a7daa Merge branch 'lammps:develop' into alphataubio-kokkos-fixes 2024-09-04 21:05:58 -04:00
18514f404f docs: mentiond build options for NVPL FFT 2024-09-04 12:00:31 -06:00
7d93460717 add commented example for implementing a command style 2024-09-04 08:23:29 -04:00
311cac0348 Add document describing how to implement a new command style 2024-09-04 05:47:59 -04:00
1b5413189d Add more details to documentation of GitHub CLI "gh" 2024-09-01 08:15:58 -04:00
a143e0a183 small corrections 2024-09-01 08:15:26 -04:00
f6f7122041 Merge branch 'doc-modified' into collected-small-changes 2024-09-01 08:09:45 -04:00
93d11c376d Fix small typo and errors, unifiy example inputs 2024-09-01 15:48:34 +08:00
d908010ead Merge branch 'develop' into patch-3 2024-08-31 01:54:29 -04:00
b2ce4051aa Consistent spacing after full stops. 2024-08-31 01:53:54 -04:00