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Diffusion lammps (lammm-master-deprecated) Graph

lammps/examples
lammm-master-deprecated

History Graph

CommitAuthorDetailsCommitted
8a8c46a372b0Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Feb 21 2011
79ec2261bb82athomps
Added some new ReaxFF examples 
Feb 19 2011
a60fdb29c5fasjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5623 f3b2605a-c512-4ea7… 
Feb 9 2011
4e98edb24290sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5622 f3b2605a-c512-4ea7… 
Feb 9 2011
582ce0423f68Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Jan 6 2011
c531b460b487Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Jan 5 2011
1dcb17a2b2cdsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5487 f3b2605a-c512-4ea7… 
Jan 5 2011
c48247fad0a1sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5486 f3b2605a-c512-4ea7… 
Jan 5 2011
b6eb5ae71c53sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5479 f3b2605a-c512-4ea7… 
Jan 5 2011
29e25bd1267eathomps
Added tad example 
Jan 5 2011
0da19470cd3cAxel Kohlmeyer
new example for sputtering process 
Dec 11 2010
b66a1ed61bc9Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Dec 11 2010
e97d56339b13athomps
Added another output file. 
Dec 9 2010
357d559ba069Axel Kohlmeyer
gpu enabled NEB examples. 
Nov 29 2010
1640f6b098f6Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Nov 12 2010
733eb154db16athomps
Tweaked TATB output 
Nov 12 2010
605509ba56f8Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Nov 6 2010
fb51a67f64a5athomps
Added potential gradient columns 
Nov 6 2010
c2ac3c93c316Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Nov 4 2010
8860ab54ecd9athomps
Modified pair_styles reax and reax/c 
Oct 26 2010
1d39d319af6asjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5098 f3b2605a-c512-4ea7… 
Oct 22 2010
f1118ab41deeAxel Kohlmeyer
Merge branch 'master' into lammps-icms 
Oct 7 2010
f1fee8d3e08dsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4991 f3b2605a-c512-4ea7… 
Oct 7 2010
b956107fc6f1Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Oct 3 2010
e915461c5fdasjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4934 f3b2605a-c512-4ea7… 
Oct 1 2010
a71eb75caabasjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4920 f3b2605a-c512-4ea7… 
Oct 1 2010
0d0fd0afac96sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4913 f3b2605a-c512-4ea7… 
Sep 30 2010
5a5b74f63150sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4903 f3b2605a-c512-4ea7… 
Sep 30 2010
ad960dcd5b31sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4807 f3b2605a-c512-4ea7… 
Sep 16 2010
d256c3afd4bbsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4806 f3b2605a-c512-4ea7… 
Sep 16 2010
e9f7f4813a5dAxel Kohlmeyer
Merge branch 'master' into lammps-icms 
Sep 7 2010
7571a9ff26d7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4718 f3b2605a-c512-4ea7… 
Sep 6 2010
0d3cb6da6bd2sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4713 f3b2605a-c512-4ea7… 
Sep 6 2010
035689173055sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4712 f3b2605a-c512-4ea7… 
Sep 6 2010
64f14417e758sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4711 f3b2605a-c512-4ea7… 
Sep 6 2010
8b16e051155csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4707 f3b2605a-c512-4ea7… 
Sep 6 2010
11933ef8fb0csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4706 f3b2605a-c512-4ea7… 
Sep 6 2010
840bc6dc4729sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4705 f3b2605a-c512-4ea7… 
Sep 6 2010
f3be54c591afsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4704 f3b2605a-c512-4ea7… 
Sep 6 2010
a133ae5a4a08sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4703 f3b2605a-c512-4ea7… 
Sep 6 2010
95253db03457sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4701 f3b2605a-c512-4ea7… 
Sep 6 2010
6783286a7c8bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4700 f3b2605a-c512-4ea7… 
Sep 6 2010
3366339dc703sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4699 f3b2605a-c512-4ea7… 
Sep 6 2010
7782572d6edesjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4698 f3b2605a-c512-4ea7… 
Sep 6 2010
df623ad1df83sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4696 f3b2605a-c512-4ea7… 
Sep 6 2010
8279ef5170c2sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4695 f3b2605a-c512-4ea7… 
Sep 6 2010
6fd6931b7fdesjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4694 f3b2605a-c512-4ea7… 
Sep 6 2010
3e07cbab43d9Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Sep 3 2010
2b332de13643sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4671 f3b2605a-c512-4ea7… 
Sep 3 2010
ef3307c36988Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Sep 2 2010
6ce7d46695c7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4648 f3b2605a-c512-4ea7… 
Sep 1 2010
7d832b4db101sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4647 f3b2605a-c512-4ea7… 
Sep 1 2010
39aea46e4c58Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Sep 1 2010
9f3153d089c1Axel Kohlmeyer
add SWCNT plus buckyball demo for fix imd. 
Sep 1 2010
de6f8589f443Axel Kohlmeyer
update imd examples for new coordinate filtering 
Sep 1 2010
cc0cf31696basjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4640 f3b2605a-c512-4ea7… 
Sep 1 2010
4cb99b91e2e7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4639 f3b2605a-c512-4ea7… 
Sep 1 2010
8d906fc56660Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Aug 31 2010
2411d53ffe34sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4629 f3b2605a-c512-4ea7… 
Aug 30 2010
42c067817726sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4628 f3b2605a-c512-4ea7… 
Aug 30 2010
009e6201de6asjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4627 f3b2605a-c512-4ea7… 
Aug 30 2010
b019664c867esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4626 f3b2605a-c512-4ea7… 
Aug 30 2010
73e63afa5bb8Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Aug 28 2010
74dc0a552bd2sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4604 f3b2605a-c512-4ea7… 
Aug 27 2010
ae926d0adea3Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Aug 21 2010
7c200a5fde06sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4550 f3b2605a-c512-4ea7… 
Aug 20 2010
d80c13054b7bAxel Kohlmeyer
Merge branch 'master' into lammps-icms 
Aug 20 2010
b59bf9bac558sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4536 f3b2605a-c512-4ea7… 
Aug 20 2010
a5e119a1676aAxel Kohlmeyer
fix final glitch in tip4p specific ev_tally call 
Jul 22 2010
d3e8436b540bAxel Kohlmeyer
add test input for tip4p water. 
Jul 22 2010
dfb10b93110dAxel Kohlmeyer
adapt pair style soft/omp to mainline changes. 
Jun 20 2010
ef413c4f5b71Axel Kohlmeyer
Merge branch 'master-small-fixes' into lammps-icms 
Jun 19 2010
aadd0209bf88sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4299 f3b2605a-c512-4ea7… 
Jun 18 2010
6ac84125bf28Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Jun 17 2010
c606246a5c71athomps
Added FixMSST in package shock 
Jun 16 2010
446838bbc1fcsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4269 f3b2605a-c512-4ea7… 
Jun 16 2010
805af3084403Axel Kohlmeyer
add example/test input for granular pair styles. 
Jun 6 2010
a4171a07fe7bAxel Kohlmeyer
added example input for colloid pair style. OpenMP seems to be broken 
Jun 6 2010
f0bb0f783db8Axel Kohlmeyer
demo/test examples for OpenMP variants of asphere 
Jun 6 2010
c35ea32df39cAxel Kohlmeyer
add a bunch more examples for tests and benchmarks. 
Jun 6 2010
2d69156a85b6Axel Kohlmeyer
adjust inputs for new fix wall/reflect syntax 
Jun 4 2010
70e05cef8eaaAxel Kohlmeyer
Merge branch 'master' into lammps-icms 
Jun 4 2010
fa9f5cf98bc6sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4239 f3b2605a-c512-4ea7… 
Jun 4 2010
b1e171fb5dd5Axel Kohlmeyer
add test and benchmark input for opls/omp 
Jun 4 2010
077e25627011Axel Kohlmeyer
add input example for dpd/tstat/omp 
Jun 3 2010
0c89650a4e50Axel Kohlmeyer
new and much smaller tests for dpd and soft. 
Jun 3 2010
8d36344d0ae3Axel Kohlmeyer
input example for OpenMP ewald. 
Jun 2 2010
0b62f0bf8572Axel Kohlmeyer
add omp version for ewald (not yet threaded). 
Jun 2 2010
b844ff3a7beeAxel Kohlmeyer
add "real world" example system for soft and dpd 
Jun 2 2010
169d93ef1f8cAxel Kohlmeyer
add test for tersoff/zbl 
Jun 1 2010
ec523ee3ef3bAxel Kohlmeyer
added OpenMP versions of tersoff and tersoff/zbl 
May 31 2010
1265471af5ddAxel Kohlmeyer
updat CG-CMM inputs, add new input for OpenMP. 
May 31 2010
96b6ca6bb227Axel Kohlmeyer
added test example input for AIREBO. 
May 28 2010
581135acccfdAxel Kohlmeyer
added test example for stillinger-weber potential. 
May 28 2010
89e1ab870e75Axel Kohlmeyer
potential table file for tabulated potential test. 
May 27 2010
f28b103beec3Axel Kohlmeyer
improved & expanded test for tabulated potentials 
May 27 2010
aca71b7dbd05Axel Kohlmeyer
add test input for tabulated potentials. 
May 26 2010
23c4f8738d66Axel Kohlmeyer
add input example for ewald/cg. 
May 26 2010
5b69d29c78d2Axel Kohlmeyer
use more /omp styles in test examples. 
May 26 2010
fb88ac682f52Axel Kohlmeyer
update gauss/cut log files with up-to-date compile. 
May 26 2010
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