Commit Graph

3892 Commits

Author SHA1 Message Date
f5f73b0172 Merge pull request #958 from ndtrung81/gpu-updates
Bug fixes and updates to the GPU package
2018-06-22 08:52:20 -06:00
cbfb751e92 made latte.in compatible with v1.1.1 and updated log files 2018-06-21 11:10:29 -06:00
a9b794b2ab Updates to the core-shell gpu pair styles 2018-06-20 10:43:13 -05:00
d4861e71d2 integrate SPIN package into documentation, fix links and make it consistent 2018-06-18 18:36:30 -04:00
605b4dca22 fix overlooked merge conflict 2018-06-18 18:09:59 -04:00
dade67664d restore bugfix for refrences 2018-06-18 18:07:26 -04:00
93d6510d34 restore deleted file 2018-06-18 18:02:40 -04:00
4f8d1893e9 restore fix for formatting cleanup 2018-06-18 18:01:28 -04:00
03a7d1cd5d Merge pull request #933 from rtoijala/fix_dt_reset_energy
Limit atom energy change in fix dt/reset
2018-06-18 13:43:03 -06:00
08331da93d Merge pull request #950 from martok/subst-equal-fmt
Add support for inline format strings to immediate variable substitution
2018-06-18 13:42:24 -06:00
ab0f3debeb Merge pull request #948 from martok/variable-string
Variable style 'string' substitutes variables in definition
2018-06-18 10:50:36 -06:00
c4bcb7e73d mention requirement to come after the box creation in Restrictions section 2018-06-15 17:52:54 -04:00
18b543179c fix typo 2018-06-15 17:47:23 -04:00
14c4438a72 update docs to reflect the state of reserving space for topology info with molecule files 2018-06-15 17:46:09 -04:00
5fcdfe6dcb describe the use of wildcards for adapting ranges of bond types 2018-06-15 17:35:43 -04:00
8a2faff541 integrate compute pentropy/atom into the documentation tree 2018-06-15 16:40:25 -04:00
c5b51df06e Add support for inline format strings to immediate variable substitution 2018-06-14 14:17:37 +02:00
3e79296dcf Variable style 'string' substitutes variables in definition 2018-06-14 13:10:08 +02:00
962946ee45 Ported fix enforce2d to Kokkos. 2018-06-01 14:52:34 -04:00
cf3095e938 document restartinfo bug message, add check to Pair::write_restart as well 2018-05-31 19:02:03 -04:00
38182dcc60 clarify docs on what energy is monitored
changes to the energy only consider the kinetic energy, so make that explicit in the augmented `fix dt/reset` docs
2018-05-31 17:32:19 -04:00
f2a6aa249f Commit2 JT 052918: doc 2018-05-29 17:18:45 -06:00
b9a8f91753 Limit atom energy change in fix dt/reset
Allow limiting of the maximum energy change of an atom in
fix dt/reset in addition to the existing distance limit.
Useful especially for high-energy irradiation.
2018-05-28 10:57:40 +03:00
f2c302c2c4 Added fix wall/body/polygon and related doc pages 2018-05-26 14:59:40 -05:00
6b9637eaa3 Added doc page for pair body rounded/polyhedron and updated related pages 2018-05-26 12:34:07 -05:00
4ca870b2a9 Updated doc page for pair body rounded/polygon 2018-05-26 11:41:15 -05:00
c960b9295c fix cut-n-paste error in fix property/local docs
correct issue reported in comment at https://github.com/lammps/lammps/pull/911
2018-05-23 16:05:32 -04:00
6de4569483 Removed unused variables - corrected documentation 2018-05-22 17:29:51 +02:00
e550f5120b Updated docs 2018-05-22 12:44:40 +02:00
1641f78e3e Merge from lammps master 2018-05-21 16:06:53 -06:00
cab602045e tweaks to doc pages 2018-05-18 08:37:29 -06:00
124641dc8a Examples - new local option 2018-05-18 15:13:48 +02:00
363d8ef775 tweaks1 2018-05-13 15:45:43 -06:00
a449488b1d simplify 2018-05-13 12:14:15 -06:00
e076d08ee9 correctly render doc page 2018-05-12 14:17:29 -06:00
ca6920be72 Merge pull request #907 from akohlmey/dump_maxfile
Implement 'dump_modify maxfiles' feature
2018-05-12 12:59:33 -06:00
0f32d603b5 tweaks to dump_modify maxfiles doc page 2018-05-11 15:52:18 -06:00
3440b1a2a7 Merge pull request #909 from lammps/tablecut
new dihedral table/cut command
2018-05-11 15:41:52 -06:00
4d34e55072 rename jpeg file, recreate tex file and fix typo in docs for dihedral style table/cut 2018-05-11 17:31:14 -04:00
821ef0cf77 update documentation for dihedral style table/cut 2018-05-11 16:08:23 -04:00
8d24101df4 patch 11May18 2018-05-11 14:04:49 -06:00
9674512997 new dihedral table/cut command 2018-05-11 07:36:40 -06:00
7780d92823 implement 'dump_modify maxfiles' feature as discussed 2018-05-10 23:25:26 -04:00
671876efef Make the description of global properties more explicit 2018-05-08 15:33:42 -04:00
53fc9f1f0f updated doc for new fix restrain output 2018-05-08 10:11:00 +02:00
a4759210a8 Merge pull request #893 from ohenrich/user-cgdna
Docs update and journal reference for USER-CGDNA package
2018-05-07 14:39:32 -06:00
7fed6c7e4c Merge pull request #634 from craabreu/master
Computation of forces/torques on rigid bodies moved to post_force
2018-05-07 14:39:10 -06:00
7cf42e42eb make links to citations unique across files 2/2 2018-05-07 14:25:18 -04:00
d80b375e26 make links to citations unique across files 1/2 2018-05-07 14:24:00 -04:00
5076b6d161 Removed old documentation 2018-05-07 18:25:55 +01:00