Commit Graph

8348 Commits

Author SHA1 Message Date
021a59965e convert to ASCII 2021-12-06 15:54:34 -05:00
fa913c3e5b clarify r_0 versus sigma 2021-12-06 15:50:09 -05:00
a84c0a43bd address spelling issues 2021-12-06 15:35:32 -05:00
c48810c545 whitespace 2021-12-06 15:29:23 -05:00
ef186d9628 Updated pair_nm.rst 2021-12-06 15:09:45 -05:00
1238f1b273 correct multiple math typesetting errors, typos, and inconsistencies 2021-12-06 14:10:41 -05:00
274ffe1f48 Consolidate "Jiang" citations 2021-12-06 14:07:36 -05:00
b0305a09e9 whitespace 2021-12-06 13:49:13 -05:00
d7c8cb3e48 fix documentation issues 2021-12-06 05:57:52 +02:00
e36029293a update documentation and examples 2021-12-04 17:38:29 +02:00
8aee8cc427 tweak documentation 2021-12-03 17:20:07 -05:00
8bc1f8b9ea whitespace 2021-12-03 17:16:54 -05:00
2d6e4d4d79 Merge branch 'develop' into nm_split_styles 2021-12-03 14:18:07 -05:00
859e0348ea fixed some issues 2021-12-03 17:45:31 +02:00
1dd4a67771 add keyword for userdefined maxdelcs 2021-12-03 17:32:08 +02:00
262c103aaa replacing hard-coded values with named constants 2021-12-03 15:46:00 +02:00
9a90803b23 Merge pull request #2984 from lammps/delete-atoms-porosity-group
Add new group arg for delete_atoms porosity
2021-12-02 16:07:49 -05:00
637c6bf28a Merge branch 'develop' into delete-atoms-porosity-group 2021-12-02 15:15:47 -05:00
2527eb5914 reorganize integration of sw/mod into the sw pair style docs 2021-12-02 12:47:18 -05:00
3dff9cf2c1 update false positives 2021-12-02 12:27:54 -05:00
8847f359ba integrate sw/mod pair style into documentation 2021-12-02 12:23:01 -05:00
718a9e2bae whitespace 2021-12-02 12:13:12 -05:00
30d3b2c209 merge rst files and add omp style 2021-12-02 15:46:00 +02:00
47f578bcca Fixup typos 2021-12-01 21:15:28 -06:00
65d31dfeb1 Adjustments to lib/kim/Install.py and docs 2021-12-01 16:49:00 -06:00
b3d7904120 Update docs 2021-11-30 11:12:30 -07:00
4a05628938 bug fixes from Doug Spearot 2021-11-30 08:22:38 -07:00
8556b71949 derived class of sw 2021-11-30 10:14:20 +02:00
f1c52ddb5c make documentation of a few pair styles more consistent with the rest 2021-11-29 15:57:11 -05:00
597054edf3 A modification to SW potential 2021-11-29 16:08:32 +02:00
4d19895a88 Merge branch 'master' into delete-atoms-porosity-group 2021-11-23 16:05:02 -07:00
ef2e51b344 whitespace fixes 2021-11-22 14:58:41 -05:00
6b605e932b Merge branch 'develop' into mixing-info 2021-11-22 14:58:19 -05:00
a83329a1a7 Merge pull request #3032 from GenieTim/compute-pair-distance-vector
Add dx, dy and dz computes to compute bond/local and property/local
2021-11-22 14:50:15 -05:00
b2dae36eb9 discuss mixing informational message 2021-11-19 14:36:00 -05:00
3d4b0121cb improve pair hybrid documentation with respect to mixing 2021-11-19 14:18:55 -05:00
4b6090a8cb Add direction consistency check to pair/local too 2021-11-18 19:28:51 +01:00
36e4e3e746 Add ddx, dy and dz computes to compute bond/local and property/local 2021-11-18 17:22:32 +01:00
15f1c2d960 Fix inaccurate error message 2021-11-18 08:50:09 -07:00
29471bd425 Merge branch 'develop' of github.com:lammps/lammps into big_dump_sort 2021-11-17 14:09:51 -07:00
377b5b4ab3 Merge pull request #3020 from akohlmey/collected-small-changes
Collected small changes and fixes
2021-11-17 14:00:13 -05:00
ef30e3bd35 clarifications and corrections for the discussion of the main git branches 2021-11-17 06:58:44 -05:00
d1403c62c8 update restrictions note for dump_modify 2021-11-05 10:56:54 -04:00
ebb3dcd9ff Remove error message 2021-11-04 20:20:07 -06:00
b3c5f6a4fd whitespace 2021-11-04 16:48:29 -04:00
935c17f02e Document multi-configuration build support in CMake 2021-11-04 16:32:21 -04:00
2cd862e4a2 Update lebedeva potential file and docs based on email on mailing list
https://matsci.org/t/lammps-users-webpage-and-parameter-file-for-the-lebedeva-potential/39059
2021-11-04 15:24:41 -04:00
8e89c7c654 correct unit description of eta_n0 parameters. fixes #3016 2021-11-04 15:24:41 -04:00
825945f783 mention that dump sorting is limited to less than 2 billion atoms 2021-11-04 15:24:41 -04:00
50f39cd752 implement and use a platform neutral abstraction of unsetenv(3) 2021-11-03 10:53:45 -04:00