Commit Graph

7403 Commits

Author SHA1 Message Date
de182aeeed fix issues due to incomplete conversion form txt2html markup 2023-03-03 17:25:28 -05:00
a136283312 update/correct section header (this is not a fix) 2023-03-03 17:17:07 -05:00
aab4750231 Update docs 2023-03-03 10:50:12 -07:00
c4f095f9df Updated the doc page of fix polarize to note that polarize/functional not supporting charged interfaces yet 2023-03-02 15:17:32 -06:00
b08fe855a1 Increased the default max iterations to 50, put a note on setting the local epsilon for charged interface particles to be the mean dielectric value 2023-03-02 15:12:59 -06:00
9b1afd7145 more description. address typos. 2023-03-02 15:54:30 -05:00
2f0aff7b78 Merge remote-tracking branch 'github/develop' into pair_style_tutorial 2023-03-02 10:34:31 -05:00
12f5bc9c77 Merge branch 'lammps:develop' into master 2023-03-02 16:10:21 +02:00
de466cf998 improve documentation of the use of verlet/split run style. reformat. 2023-03-02 07:31:33 -05:00
63a391a649 replace leftover -DCUDA_PROXY 2023-03-01 21:05:22 -05:00
e4e994f1b1 add missing versionadded tags 2023-03-01 20:59:48 -05:00
8a1771aa61 implement documented pair style requirements for DPD-MESO intgreation fixes 2023-03-01 20:52:23 -05:00
c5c787ca5c better align with docs bundled with the MSCG library 2023-03-01 20:41:36 -05:00
a715a56afe fix typo 2023-03-01 20:41:00 -05:00
87a9695c64 Merge remote-tracking branch 'github/develop' into collected-small-changes 2023-03-01 20:37:50 -05:00
d44ba14030 Merge pull request #3657 from akohlmey/custom-wall-fixes
Add fix wall/table and fix wall/lepton for customizable wall fixes
2023-03-01 20:16:56 -05:00
c1e14e09f3 add more source code. remove remnants of the fix page 2023-03-01 17:16:36 -05:00
11172c1949 make biga0 and r0 accessible via Pair::extract() and add pair style to table in fix adapt 2023-02-28 21:50:44 -05:00
2507e414d9 fix broken link 2023-02-28 18:11:05 -05:00
a98c497dbb redesign the Howto pages on water models and add inputs and molecule files 2023-02-28 18:10:45 -05:00
202a22ea68 Merge branch 'develop' into collected-small-changes 2023-02-28 11:27:26 -05:00
02190b82c2 link pair style hybrid/scaled to fix adapt and fix alchemy 2023-02-28 11:22:28 -05:00
a6eac92cd5 update list of pair styles that support fix adapt 2023-02-28 11:20:33 -05:00
f866c1d961 Merge branch 'lammps:develop' into master 2023-02-28 11:54:23 +02:00
02c26f4b87 add version tag 2023-02-27 16:53:43 -05:00
81a2d47c16 print warning about not checking lambda variable 2023-02-27 16:50:17 -05:00
446913f2f3 make ramp more flexible by defining lambda through a variable 2023-02-27 16:01:17 -05:00
83f936f31b Update fix_alchemy.rst 2023-02-27 11:00:11 -07:00
93b42f14e9 start document describing the implementation of a pair style 2023-02-27 01:58:59 -05:00
c8f3f4b173 add born/gauss pair style (for modeling liquid mercury) 2023-02-27 01:58:36 -05:00
8368b78f23 document the change in mass handling 2023-02-26 13:52:31 -05:00
f84765f29e update document for fix pimd/langevin 2023-02-25 20:34:10 -05:00
c9b22ba04f mention pair style hybrid/scaled as alternative 2023-02-25 17:17:41 -05:00
0911565660 prepare for inclusion of fix pimd/langevin 2023-02-25 16:36:01 -05:00
bb17541c30 add simple example for transforming a pure metal into an alloy 2023-02-25 16:01:26 -05:00
2bad63c68e add documentation 2023-02-25 14:09:14 -05:00
828b70fbfa silence warning 2023-02-25 13:58:58 -05:00
7d3b9e4dda another doc page change 2023-02-24 16:27:15 -07:00
ea73ddcb59 remove all files and dirs relevant to the fix latte command 2023-02-24 16:13:50 -07:00
ea6ec5c70f more doc updates 2023-02-24 13:41:59 -07:00
37d6014f40 updated doc pages and README files 2023-02-24 13:32:58 -07:00
d831562e1f Fixing typo in equation for fene/nm 2023-02-24 12:27:53 +02:00
6ae177f37e rename fix pimd to fix pimd/nvt (with backward compatibility) 2023-02-23 12:26:42 -05:00
ec87c71064 add documentation for fix wall/lepton, fix wall/table and WallTabulate() 2023-02-23 00:35:25 -05:00
d2faf86214 Merge branch 'develop' into bond-harmonic-restrain 2023-03-14 00:41:28 -04:00
17f39d9d2c rename fix STORE/PERATOM to STORE/ATOM 2023-03-13 22:33:47 -04:00
1031110d93 update docs 2023-03-13 19:55:52 -04:00
3ba37fc954 Merge branch 'develop' into bond-harmonic-restrain 2023-03-13 19:43:16 -04:00
b6756c0319 update docs about using data files 2023-03-09 13:00:59 -05:00
010b030b56 update docs and mention alternatives and describe differences 2023-03-07 19:38:34 -05:00