Commit Graph

7403 Commits

Author SHA1 Message Date
8bddf105bf Updated version of equations, documentation. 2017-04-28 20:22:22 -05:00
31446e35b9 Cleanup on equations; JPG to be constructed. 2017-04-28 15:31:49 -05:00
9bdc43bb66 Updates to pair/meam/spline documentation. 2017-04-28 15:15:21 -05:00
a0b61d17b5 Updates to documentation: equation. 2017-04-28 15:08:59 -05:00
af74874516 rename references to USER-CG-CMM to USER-CGSDK 2017-04-26 19:27:13 -04:00
8f9cb3590a correct units for some improper force constants in docs 2017-04-26 15:34:12 -04:00
ddc1e4e86e detect and refuse to run pair style srp together with fix rigid 2017-04-25 13:27:20 -04:00
396e0b5423 correct broken link in html bond doc overview 2017-04-21 14:02:17 -04:00
4e411364ff add support to pair_modify to selectively disable compute/tally callbacks in sub-styles for pair hybrid and hybrid/overlay 2017-04-21 14:01:38 -04:00
dfa9815246 update for fix gle docs from michele ceriotti 2017-04-18 17:07:28 -04:00
481927ff16 correct 'thrid' instead of 'third' 2017-04-17 17:49:49 -04:00
dd90c860ee refactor msi2lmp documentation to emphasize lack of active development
- put a note into the manual
- reorder contents of the README file
- request for information should be sent to lammps-users
- add list of known missing features
2017-04-17 17:40:21 -04:00
c9bc141335 remove doc text explaining restrictions that are lifted with the changes in this branch 2017-04-14 12:57:35 -04:00
2f32fb7f8b patch 13Apr17 2017-04-13 11:19:48 -06:00
4da8c1c4e2 patch 11Apr17 2017-04-11 09:00:37 -06:00
49dd9449b8 fix gcmc updates from Aidan, trimming of output for replica commands 2017-04-11 08:35:09 -06:00
06cebb9fb4 Merge pull request #445 from Pakketeretet2/extract_for_bond
Extract for bond
2017-04-11 08:27:31 -06:00
b9d844ca8d Merge pull request #444 from ohenrich/user-cgdna
Minor updates to docu of USER-CGDNA package
2017-04-11 08:25:09 -06:00
84ea8a79e6 correct link for dispersion parameter how-to and reformat 2017-04-10 20:43:24 -04:00
497a5d88af Merge branch 'master' into user-cgdna 2017-04-04 20:03:57 +01:00
8993daaa31 Minor update to docu 2017-04-04 19:54:22 +01:00
28e86917a0 Made fix adapt work with bond_harmonic. 2017-04-04 12:35:26 -04:00
ae56b9ad89 patch 31Mar17 for stable release 2017-03-30 10:07:27 -06:00
c733204a70 Updated lammps.book and install script 2017-03-29 08:28:03 +01:00
4b9d0a9566 sync with SVN 2017-03-28 13:26:12 -06:00
0637f23875 patch 28Mar17 2017-03-28 13:12:23 -06:00
9f6e126a2f Merge pull request #437 from ohenrich/user-cgdna
User cgdna
2017-03-28 12:52:26 -06:00
80e5111dca Merge pull request #434 from akohlmey/imgflags-in-library
improved image flag handling in library interface
2017-03-28 12:50:13 -06:00
1d8f0c762d Merge branch 'master' into fixes-for-stable 2017-03-28 14:37:30 -04:00
111d350a22 fix gcmc units change for chemical potential 2017-03-28 12:34:46 -06:00
66a6375405 Resolved merge conflict 2017-03-28 18:58:31 +01:00
604afebf6f Update to oxDNA2 2017-03-28 18:22:02 +01:00
8afed61db1 Upgrade to oxDNA2 2017-03-28 18:16:36 +01:00
f8da9a866a synchronize dump custom/vtk documentation with that of dump custom 2017-03-28 11:00:22 -04:00
fc51c38abb add some docs for the special treatment of image flags 2017-03-28 02:22:45 -04:00
a241b2d0f7 fix problems with references 2017-03-27 15:01:32 -04:00
61e7595a94 remove references to xmovie, streamline dump and viz descriptions 2017-03-27 14:59:58 -04:00
3dfe4505dd 24Mar17 patch sync with SVN 2017-03-24 15:17:51 -06:00
394e9b42b0 new CHARMM pair styles with force swithing/shifting 2017-03-24 13:53:07 -06:00
f5a85d68ad Merge pull request #429 from akohlmey/updates-for-stable
Collected updates for stable release
2017-03-24 10:01:23 -06:00
277b93cb89 Merge pull request #417 from tonnamb/add-pair-zhou
add new pair potential for metal-organic interactions - pair style momb
2017-03-24 09:41:30 -06:00
8820315ff9 Merge branch 'master' into updates-for-stable 2017-03-23 17:57:02 -04:00
44841f6891 fix ave/chunk fixes, 2d disc option, fix_modify dynamic/dof 2017-03-23 15:31:27 -06:00
2cdcd6d630 remove one more reference to xmovie 2017-03-23 16:03:25 -04:00
b88a749680 rename a couple more references to pair style zhou into momb 2017-03-23 11:38:33 -04:00
6d395ec511 change name zhou to momb in docs, fix grammar 2017-03-23 10:08:47 -04:00
bf560e78f3 edit description and add related commands and default 2017-03-22 16:56:40 -04:00
1db5834b99 Revert "Cleanup of a few more references to obsoleted and removed tools like xmovie"
This reverts commit 127597023d.
2017-03-22 15:12:49 -04:00
3070b043be Revert "correct inconsistent anchors"
This reverts commit a14d58259c.
2017-03-22 15:12:47 -04:00
ef3f323fc4 Revert "remove reference to removed section on VMD scripts"
This reverts commit 66eb9c2486.
2017-03-22 15:12:43 -04:00