4d98bbdfa5
Almost done with the tutorial now
2017-01-02 18:08:14 +01:00
391ab761a4
Finally updated the github tutorial.
2017-01-02 17:55:02 +01:00
aa146e9b38
Moved fix_nvk to USER-MISC, updated documentation to reflect move
2016-12-28 19:06:35 +01:00
68814d4fc8
Made documentation changes to fix nvk
2016-12-28 16:26:05 +01:00
616ca1de03
Fix nvk implemented.
2016-12-28 16:17:07 +01:00
925f42727f
Fix typo
2016-12-27 14:26:43 -05:00
f553e230db
Update Colvars library to version 2016-12-22
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Significant code cleanup and several fixes (walls + extended Lagrangian)
New harmonicWalls bias to apply confining boundaries with time-dependent force
constant & integration
2016-12-27 13:17:34 -05:00
781daad2a0
USER-DPD: update documentation for changes in commit 3faa57
2016-12-22 17:31:17 -05:00
62dea1bb63
21Dec16 patch
2016-12-21 09:53:32 -07:00
81a2db8a0c
17Dec16 patch
2016-12-16 11:36:54 -07:00
3027ac9250
patch 16Dec16
2016-12-16 10:30:57 -07:00
e364b80724
added length keyword to python command
2016-12-16 10:24:25 -07:00
f509f133af
patch 13Dec16: neighbor refactor, Stan pppm/disp bug fix, M Brown INTEL package updates
2016-12-13 17:14:28 -07:00
f3b355bcbe
Merge pull request #298 from akohlmey/collected-small-fixes
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Collected small fixes
2016-12-13 16:23:23 -07:00
ae5764beac
added functionity to lib interface
2016-12-13 16:22:17 -07:00
ddf678da51
make fix gcmc command overview consistent
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this closes #296
2016-12-09 14:30:27 -05:00
d3d5ac17bf
Fixed small typos in doc
2016-12-07 19:37:51 -08:00
fb3f597f41
30Nov16 patch
2016-11-30 14:04:41 -07:00
d14814ae2e
Merge pull request #289 from akohlmey/collected-updates-and-bugfixes
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Collected updates and bugfixes
2016-11-30 14:02:41 -07:00
beb5a30f67
new compute global/atom command, also bug fix for descending dump sorts
2016-11-30 14:01:27 -07:00
42d430168b
fix typo in compute cluster/atom docs
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this closes #292
2016-11-29 07:24:09 -05:00
02ae2d218a
correct broken link to USER-SMD docs PDF
2016-11-28 11:34:22 -05:00
87781771ba
fix typo and USER-OMP support omission
2016-11-23 09:02:32 -05:00
59d100ab57
final prep for 22Nov patch
2016-11-22 09:23:02 -07:00
b6f2f0e6e9
Merge pull request #287 from rbberger/pylammps/docs
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Created PyLammps documentation
2016-11-22 08:50:29 -07:00
ff0441ac16
Merge pull request #286 from akohlmey/small-fixes-and-updates
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Collected small fixes and updates
2016-11-22 08:49:46 -07:00
41907d3110
Merge pull request #285 from akohlmey/fix-ipi-update
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update for fix ipi from michele ceriotti
2016-11-22 08:48:27 -07:00
b95f255af4
small changes to temper/grem commands
2016-11-22 08:47:44 -07:00
87a5a35bad
A tiny bugfix for the reset flag, and a brief explanation of the changes
2016-11-20 00:44:23 +01:00
230b29eae6
correct accelerator flags for dpd styles in pair style overview
2016-11-19 11:47:12 -05:00
2383c31f15
Created PyLammps documentation
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Based on material presented during MD Workshop at Temple University in
August 2016.
2016-11-18 23:58:57 -07:00
d787afcca9
also remove generated html files with 'make clean' in docs folder
2016-11-18 15:37:49 -05:00
176cde8ed3
minor cleanups
2016-11-18 15:36:38 -05:00
2862c20815
Merge branch 'master' into grem-feature
2016-11-18 14:51:46 -05:00
78e018829f
Merge branch 'grem-feature' of https://github.com/dstelter92/lammps into grem-feature
2016-11-18 14:48:47 -05:00
4b51719e67
new 17Nov16 patch and stable
2016-11-17 16:51:35 -07:00
25d7be5f3d
compute pressure doc change
2016-11-17 16:11:30 -07:00
74c0e4dd5c
Merge pull request #278 from akohlmey/pair-agni
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Implementation of the AGNI manybody potential
2016-11-17 09:04:31 -07:00
073e8a0524
Merge pull request #276 from akohlmey/doc-updates
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Small bugfixes and updates
2016-11-17 09:02:27 -07:00
2535e44991
Merge pull request #271 from akohlmey/tersoff-modc
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pair style tersoff/mod/c
2016-11-17 09:00:52 -07:00
747c95c525
revised documentation, added temper_grem ref to fix_grem
2016-11-17 11:00:49 -05:00
8756a1017d
Kokkos updates by Stan
2016-11-17 08:58:22 -07:00
5c64934bc8
added documention, re-ran temper_grem example
2016-11-17 10:40:10 -05:00
b45d1e37ef
integrate fix grem docs and update to match current conventions
2016-11-16 16:46:00 -05:00
16c8a307e5
removed leftover tex files
2016-11-16 15:39:02 -05:00
94f14ab051
spell check, minor typos
2016-11-16 15:34:32 -05:00
4641c9e568
Added basic documentation for grem fix
2016-11-16 13:36:13 -05:00
57124b9b25
update documentation metadata files for recent changes
2016-11-12 09:18:21 -05:00
03b3834fe3
add documentation for pair style agni
2016-11-12 09:07:42 -05:00
1f38e1a771
Merge branch 'master' into doc-updates
2016-11-09 18:18:05 -05:00
