Commit Graph

7403 Commits

Author SHA1 Message Date
9d3e9c6146 whitespace 2024-04-10 18:03:01 -04:00
dbb23b6006 Merge branch 'develop' into pedone-potentials 2024-04-10 18:02:31 -04:00
120b861f80 correct typos and remove duplicate text 2024-04-10 12:56:43 -06:00
03fc889df9 Merge branch 'rheo' of github.com:jtclemm/lammps into rheo 2024-04-10 12:18:02 -06:00
7a80a74791 Merge branch 'develop' into jake_replicate 2024-04-10 11:32:43 -06:00
1135d6be64 Noting artificial/visc exception in doc 2024-04-10 10:44:41 -06:00
e180527f08 fix typo 2024-04-10 12:35:09 -04:00
5383bd2613 More doc files, misc clean ups 2024-04-10 09:47:55 -06:00
06d579eb51 improve atomfile variable docs 2024-04-10 06:29:10 -04:00
b4fa1b07e9 add version tag 2024-04-09 22:21:34 -04:00
01917cd117 add example for Ca-O with Pedone 2024-04-09 22:08:30 -04:00
7ac84e18dd remove references to non-existing pedone/coul/long, complete description 2024-04-09 21:35:45 -04:00
41591826fb update 2 doc pages for DIELECTRIC package 2024-04-09 09:25:21 -06:00
aeec608be6 partial docs also for future pedone/coul/long implementation 2024-04-09 09:13:23 -04:00
21512df264 update doc for dump_modify triclinic/general keyword 2024-04-08 17:59:44 -06:00
f1c2a22e2d more tweaks 2024-04-08 16:25:17 -06:00
e40a1527d3 one more doc page 2024-04-08 10:53:14 -06:00
d1b571c8ed spell check 2024-04-08 10:48:38 -06:00
c2b91ccc8a better documention and error checking for 2d general triclinic 2024-04-08 10:43:20 -06:00
1a019889f2 more doc page and thermo edge vector modifications 2024-04-05 16:22:54 -06:00
4a36053bbb Merge branch 'develop' into general-triclinic 2024-04-05 15:50:55 -06:00
7122a85c0b remove some debug info 2024-04-05 15:43:54 -06:00
d615d8053b support for general tri edge vectors in thermo output 2024-04-05 14:31:53 -06:00
905ceb98f1 merge in current develop 2024-04-05 09:36:29 -06:00
1b71576b6f Update CMake and docs 2024-04-05 09:09:44 -06:00
84b6c6a088 Added prefactors and errors for incorrect combinations. 2024-04-05 09:58:33 -05:00
dc1bc8a8cf Merge branch 'lammps:develop' into cg-dna 2024-04-05 11:40:16 +01:00
ceec24d50b Adding hybrid support to BPM, more doc pages 2024-04-04 09:42:10 -06:00
ef3d255a4b Merge branch 'develop' into pace-mliap 2024-04-03 20:49:29 -04:00
c0abefeacb update links in manual to jacobi3() docs 2024-04-02 23:53:25 -04:00
0809d8b722 Updated documentation about METADATA in the uf3 lammps pot files 2024-04-02 13:17:13 -04:00
ed0cff92de Merge remote-tracking branch 'github/develop' into general-triclinic 2024-04-02 09:41:21 -04:00
08db64c27f More updates for oxidation, more doc pages 2024-03-31 21:40:34 -06:00
d73aec6c21 add OpenMP version of angle style cosine/squared/restricted 2024-03-29 21:31:40 -04:00
b712e46497 doc fixes 2024-03-29 21:00:51 -04:00
7ea0dc3996 Adding more oxidation features + doc pages 2024-03-29 19:00:14 -06:00
9c85e5a99b fix bug in option arg parsing of fix ave/correlate, also update doc page for fix ave/correlate/long 2024-03-29 14:27:43 -06:00
b8fc8e5e63 Update dihedral_style.rst 2024-03-29 11:18:11 +01:00
a9deb029e3 Add files via upload 2024-03-29 11:15:36 +01:00
996f5b9d52 fix ttm doc formatting fixes 2024-03-29 02:50:30 -04:00
a6e5c8b981 update more files and docs for .uf3 potential file extension
also remove redundant files
2024-03-28 17:32:07 -04:00
eb89c7a392 examples folder was moved 2024-03-28 17:01:37 -04:00
010a4c076b Prototyping oxidation 2024-03-28 11:31:21 -06:00
2a8a7f6365 Update angle_style.rst
Include link to rst file of the restricted angle potential
2024-03-28 15:47:37 +01:00
0893a2d0a0 Add files via upload 2024-03-28 15:43:01 +01:00
fda433a7ee reformat and fix spelling and related issues 2024-03-27 06:53:03 -04:00
cd154abe73 add "Incorrect format in ... section of data file" to Error_details and url 2024-03-26 23:56:38 -04:00
b01efd96a5 add missing link and expand docs for Unknown identifier in data file error 2024-03-26 23:27:44 -04:00
ff39a03e83 Removed trailing whitespaces 2024-03-26 13:14:32 -04:00
4e95db1bb7 Added uf3 details to Commands_pair, Packages_details and Packages_list 2024-03-26 12:34:29 -04:00