Commit Graph

7403 Commits

Author SHA1 Message Date
1b76e14224 Merge pull request #1151 from akohlmey/next-patch-release
update version number for next patch release
2018-10-10 02:20:50 +02:00
9a0c02a845 Merge pull request #1150 from mkanski/compute_pair_multiple_pstyles
Extend compute pair to handle multiple instances of a sub-style in pair style hybrid
2018-10-10 00:48:52 +02:00
70bee26641 update version number 2018-10-09 12:59:12 -04:00
791024586e Merge pull request #1131 from ckadding/master
Add compute_pressure_cylinder to USER-MISC package
2018-10-09 18:40:02 +02:00
962fd1df90 Merge pull request #1146 from jrgissing/maxspecial_restarts
put atom->maxspecial in restarts
2018-10-09 17:55:24 +02:00
3c41295e70 change implementation to be consistent with pair_coeff and remain backward compatible 2018-10-08 17:23:22 +02:00
8b944e06f0 Small changes in doc file 2018-10-05 21:08:18 +02:00
1e9778b81e Extend compute pair to handle multiple instances of a given pair style 2018-10-05 20:34:12 +02:00
d805796cd7 Merge pull request #1133 from lammps/doc-adjust
Multiple documentation adjustments and corrections from Steve and Axel
2018-10-05 20:20:18 +02:00
fd20eb93b2 remove listing of extinct special_bonds 'extra' keyword 2018-10-04 21:30:34 -06:00
f81836d605 reformat compute pressure/cylinder docs and integrate it into the manual 2018-10-02 11:51:23 -04:00
b5a5270f4a fix typos in compute msd/chunk
as reported by @evoyiatzis the example is incorrect,
but also a mention of the compute a few lines above.
2018-10-02 16:29:18 +02:00
69c3ff560e Clarify restrictions and output 2018-10-02 10:11:57 -04:00
dba8f9c62b Merge pull request #1137 from dilkins/fast-forward-langevin
Fast-forward Langevin functionality included in USER-MISC package
2018-10-02 14:19:37 +02:00
4b4f7d6ee0 implement conventions for unique links in docs 2018-10-02 11:25:12 +02:00
66bfdd20d4 fully integrate fix ffl docs into the manual system 2018-10-02 11:24:45 +02:00
990a93f9d9 fix typo in example input 2018-10-02 10:58:28 +02:00
f61f43a56b Merge branch 'master' into kim-v2-update 2018-10-01 21:17:26 -05:00
799ffc58d9 C++ system headers included and enumeration of flip_int used;documentation corrected 2018-10-01 17:13:56 +02:00
a333fdac30 correct some documentation issues with the recently added USER-PTM package 2018-09-28 18:02:13 +02:00
ffbc33bea5 Merge branch 'master' into doc-adjust 2018-09-28 17:07:51 +02:00
12d2dd201a update description of RPM based LAMMPS packages with info from @junghans
this fixes #1135
2018-09-28 15:47:56 +02:00
497af2ebb9 document eam/cd/old 2018-09-28 13:44:42 +02:00
21c59d4cf0 Fast-forward Langevin functionality included 2018-09-28 12:46:11 +02:00
4fe23c3854 Merge pull request #1120 from pmla/polyhedral-template-matching
Added compute for Polyhedral Template Matching
2018-09-28 12:26:06 +02:00
f58aa05e02 remove references to USER-OMP version of pair style nb3b/harmonic 2018-09-27 07:44:54 -04:00
e1627caf04 integrate compute ptm/atom and USER-PTM into the docs 2018-09-27 07:20:03 -04:00
91286ddb0e remove references to fix ave/spatial and ave/spatial/sphere 2018-09-27 06:51:30 -04:00
cf0f3b6b61 Update manual for renamed or removed files 2018-09-27 06:23:59 -04:00
7987f3319e remove outdated references to linux rpms on rpm.lammps.org 2018-09-27 06:05:26 -04:00
b07adbf98c Update installing/running LAMMPS on ubuntu for daily binary 2018-09-27 05:49:43 -04:00
a9b8a6521d more mis-matches between doc pages and src files 2018-09-25 13:18:54 -06:00
5a6226caa5 jive src headers with doc page entries and example scripts 2018-09-25 10:50:43 -06:00
36c5fb2ec6 update formatting 2018-09-24 10:37:52 -04:00
918030bf1c Merge branch 'master' of https://github.com/oywg11/lammps into ilp-update 2018-09-24 10:29:08 -04:00
dd39bc44ee Add compute_pressure_cylinder documentation 2018-09-20 09:16:58 -04:00
8dff5fd5d7 patch 18Sep18 2018-09-18 17:24:10 -04:00
e2293cc7df Merge pull request #1119 from lammps/doc-clarify
doc page clarifications
2018-09-17 06:10:25 -04:00
0c287a55cd Merge pull request #1092 from RomainVermorel/master
New stress/mop and stress/mop/profile computes for USER-MISC
2018-09-17 05:16:42 -04:00
5f6b5c5400 fix typo 2018-09-17 05:11:59 -04:00
494b149272 fix typo 2018-09-17 05:10:56 -04:00
39ee7876c4 fix typo 2018-09-17 05:09:23 -04:00
8fa80081df fix typo 2018-09-17 05:08:22 -04:00
e14db00d52 doc link adjustments 2018-09-14 17:31:33 -06:00
7054800932 Merge branch 'master' into master 2018-09-12 22:13:43 +03:00
01beaf38a1 small modifications for potential #839 2018-09-12 21:51:57 +03:00
83b6d6ae96 small modifications of potential #839 2018-09-12 17:47:16 +03:00
6ae4bdead5 Merge pull request #1089 from lammps/spread
2 new computes: chunk/spread/atom and reduce/chunk
2018-09-11 21:21:02 -04:00
92b508f14c Merge pull request #1097 from lammps/localvars
add variable option to compute bond/angle/dihedral local
2018-09-11 21:18:15 -04:00
b7c75b6c4e Added compute for Polyhedral Template Matching 2018-09-11 16:41:44 -04:00