sjplimp
|
f31dfc6c47
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6223 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-05-26 23:45:30 +00:00 |
sjplimp
|
465cbbd0ed
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6222 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-05-26 23:45:23 +00:00 |
sjplimp
|
b220fdbcf5
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6220 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-05-26 22:35:54 +00:00 |
athomps
|
2ddc39d3d8
|
Added equations for inverse box transformation
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6214 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-05-23 19:09:02 +00:00 |
sjplimp
|
1c79295aa1
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6212 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-05-23 14:35:19 +00:00 |
sjplimp
|
813ffdc80d
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6198 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-05-20 23:25:17 +00:00 |
sjplimp
|
157ffd67ae
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6197 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-05-20 23:21:12 +00:00 |
sjplimp
|
91b6d45b53
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6195 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-05-20 22:46:32 +00:00 |
sjplimp
|
a721c56f19
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6124 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-05-17 23:43:48 +00:00 |
sjplimp
|
b1d3687d40
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6076 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-05-05 15:43:49 +00:00 |
sjplimp
|
f6151f6735
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6051 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-05-02 15:01:49 +00:00 |
athomps
|
1773dd293f
|
reverted accidental change
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6048 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-04-29 23:44:34 +00:00 |
athomps
|
21de807010
|
Added xsu, ysu, zsu to dump custom and dump cfg
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6043 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-04-29 23:38:34 +00:00 |
sjplimp
|
72644dcb8d
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6034 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-04-29 16:27:56 +00:00 |
athomps
|
ed2ac8315f
|
Added errata to Tersoff_2 ref
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6018 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-04-26 17:53:53 +00:00 |
sjplimp
|
70a043a91e
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5964 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-04-16 22:25:00 +00:00 |
sjplimp
|
e7038083a9
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5953 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-04-15 23:16:56 +00:00 |
sjplimp
|
d6f7a7383e
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5952 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-04-15 23:14:41 +00:00 |
sjplimp
|
e2d5478a6c
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5951 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-04-15 22:57:52 +00:00 |
sjplimp
|
a043191781
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5941 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-04-14 19:17:39 +00:00 |
sjplimp
|
c14ad97fed
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5936 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-04-13 21:56:07 +00:00 |
sjplimp
|
e45fbd89d1
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5931 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-04-13 21:39:34 +00:00 |
sjplimp
|
0d56ce0615
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5925 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-04-11 19:49:41 +00:00 |
sjplimp
|
8d92fd5fc4
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5898 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-04-05 19:14:58 +00:00 |
sjplimp
|
1eb3bade21
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5867 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-03-28 21:35:31 +00:00 |
sjplimp
|
5709901754
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5865 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-03-28 14:58:14 +00:00 |
sjplimp
|
72fbf1b5f5
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5860 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-03-28 14:39:41 +00:00 |
sjplimp
|
8cb9845237
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5859 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-03-28 14:28:24 +00:00 |
athomps
|
56f53d83cc
|
Added zerosum option
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5858 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-03-28 00:13:42 +00:00 |
sjplimp
|
0fe876a199
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5853 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-03-26 23:18:28 +00:00 |
sjplimp
|
72289a2606
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5811 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-03-23 13:54:53 +00:00 |
sjplimp
|
6f7c9538c8
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5798 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-03-18 15:09:16 +00:00 |
sjplimp
|
930121fd0f
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5788 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-03-15 14:36:35 +00:00 |
sjplimp
|
5c80433034
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5775 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-03-10 16:41:36 +00:00 |
sjplimp
|
96a806fb4f
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5766 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-03-08 22:23:59 +00:00 |
sjplimp
|
225c9c9fc7
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5757 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-03-07 23:01:59 +00:00 |
sjplimp
|
46104f1588
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5711 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-02-22 22:29:54 +00:00 |
sjplimp
|
eae0731cae
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5700 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-02-22 20:30:51 +00:00 |
sjplimp
|
4c1f1f9b01
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5687 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-02-21 22:32:31 +00:00 |
sjplimp
|
ca0e621108
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5658 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-02-15 21:25:32 +00:00 |
sjplimp
|
eaa65992c5
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5654 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-02-15 21:14:11 +00:00 |
sjplimp
|
04d7392280
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5642 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-02-15 18:42:22 +00:00 |
sjplimp
|
dbf221c336
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5636 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-02-15 16:12:41 +00:00 |
sjplimp
|
b754d37a02
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5626 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-02-11 15:28:32 +00:00 |
athomps
|
5ebee66a24
|
Added comment on units
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5615 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-02-08 23:18:27 +00:00 |
sjplimp
|
f903896d3b
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5608 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-02-07 23:59:23 +00:00 |
sjplimp
|
eecdc88d9d
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5606 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-02-07 23:55:28 +00:00 |
sjplimp
|
cf075da9f0
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5605 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-02-07 23:54:50 +00:00 |
sjplimp
|
7d5603963f
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5604 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-02-07 23:54:38 +00:00 |
sjplimp
|
3ad614b04a
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5590 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-02-04 19:13:00 +00:00 |
athomps
|
020cd3dad0
|
Tweaked log output again
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5575 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-25 05:16:37 +00:00 |
athomps
|
5fb239dcf5
|
Tweaked explanation of output for executed events
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5574 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-24 18:37:03 +00:00 |
athomps
|
270bc5fdcb
|
Tweaked event output
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5571 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-22 01:03:17 +00:00 |
sjplimp
|
4b8beadb2f
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5566 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-19 15:57:11 +00:00 |
sjplimp
|
18b821f1d0
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5551 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-14 16:08:31 +00:00 |
sjplimp
|
52e8782482
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5540 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-12 15:27:28 +00:00 |
sjplimp
|
c292901594
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5539 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-12 15:25:57 +00:00 |
sjplimp
|
fe81632989
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5530 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-11 19:27:27 +00:00 |
sjplimp
|
9f55cc26d9
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5527 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-11 16:27:33 +00:00 |
sjplimp
|
4558c28bbc
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5522 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-11 00:43:33 +00:00 |
sjplimp
|
beabb5e05a
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5503 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-07 21:40:58 +00:00 |
athomps
|
0c112cf3db
|
Tweaked multireplica docs
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5490 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-05 18:03:37 +00:00 |
sjplimp
|
29eaf00e77
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5481 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-05 15:46:03 +00:00 |
sjplimp
|
953a7bc7eb
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5480 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-05 15:43:09 +00:00 |
athomps
|
4e99c5022e
|
Added tad example
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5474 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-04 23:39:13 +00:00 |
sjplimp
|
f3300e9536
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5455 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-04 19:00:12 +00:00 |
sjplimp
|
d82f4c3460
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5452 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-03 23:05:56 +00:00 |
sjplimp
|
cf905573f8
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5441 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-03 17:10:54 +00:00 |
sjplimp
|
203b6e32d2
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5440 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-03 16:55:43 +00:00 |
sjplimp
|
d4769d99a3
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5439 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-01-03 16:42:55 +00:00 |
sjplimp
|
c49be34d06
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5438 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2010-12-23 18:44:17 +00:00 |
sjplimp
|
bd1c701a6d
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5433 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2010-12-23 16:12:21 +00:00 |
sjplimp
|
f4487dd731
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5431 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2010-12-23 16:08:16 +00:00 |
sjplimp
|
43bf138ce2
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5419 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2010-12-20 21:47:10 +00:00 |
sjplimp
|
6fc147897b
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5418 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2010-12-20 15:53:15 +00:00 |
sjplimp
|
94d3b7fb0e
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5414 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2010-12-20 15:45:02 +00:00 |
sjplimp
|
c30950ddcc
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5404 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2010-12-17 18:14:26 +00:00 |
sjplimp
|
f74bb8a6f2
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5400 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2010-12-15 17:17:55 +00:00 |
sjplimp
|
f5dc4a57a6
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5366 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2010-12-07 15:40:31 +00:00 |
sjplimp
|
71cb6d3821
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5365 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2010-12-07 15:26:24 +00:00 |
sjplimp
|
3286b2e8c4
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5364 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2010-12-06 15:43:27 +00:00 |
sjplimp
|
b09f5100c6
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5356 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2010-12-02 15:33:15 +00:00 |
sjplimp
|
401feb8078
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2010-11-23 15:13:14 +00:00 |
pscrozi
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Changes from Mike Changes from Mike Brown.
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2010-11-17 16:14:03 +00:00 |
athomps
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30438cb7b3
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Document how to set unused parameters to zero
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sjplimp
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2010-11-10 17:29:32 +00:00 |
athomps
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6813e71251
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Added potential gradient columns
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2010-11-05 23:57:57 +00:00 |
athomps
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0128dca0c5
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Added potential gradient columns
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sjplimp
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sjplimp
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2010-10-27 20:54:22 +00:00 |
athomps
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f2b88626a0
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Added check for qeq and option to turn off check
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2010-10-27 15:48:03 +00:00 |
athomps
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ad75964dc2
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Modified pair_styles reax and reax/c
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sjplimp
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2010-10-25 20:29:16 +00:00 |
athomps
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3d4e086b2d
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Added potential gradient columns
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sjplimp
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2010-10-22 21:24:19 +00:00 |
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2010-10-22 16:48:10 +00:00 |
sjplimp
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2010-10-22 15:23:51 +00:00 |
athomps
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a055b4b7ac
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Fixed typo in elastic constant how-to
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2010-10-21 21:18:22 +00:00 |
sjplimp
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2010-10-21 17:31:01 +00:00 |
athomps
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f2b5156d74
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Removed output_itemized_energy(), added compute pair support
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2010-10-19 00:56:30 +00:00 |
athomps
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e283bf3157
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Removed output_itemized_energy(), added compute pair support
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2010-10-19 00:55:56 +00:00 |
sjplimp
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2010-10-18 20:09:01 +00:00 |
sjplimp
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2010-10-18 20:07:43 +00:00 |
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2010-09-27 16:37:01 +00:00 |
athomps
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38867b49df
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Added hbnewflag argument to pair_style reax
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sjplimp
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sjplimp
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sjplimp
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sjplimp
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sjplimp
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3dfd2c2676
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sjplimp
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2010-08-27 14:40:00 +00:00 |
sjplimp
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02adb67715
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2010-08-25 15:39:16 +00:00 |
sjplimp
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ff9d3b9578
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sjplimp
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2010-08-24 14:39:37 +00:00 |
athomps
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e5514e10d8
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Changed default tchain for FixNVTSllod
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2010-08-20 23:17:55 +00:00 |
sjplimp
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sjplimp
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sjplimp
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2010-08-20 00:37:54 +00:00 |
sjplimp
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sjplimp
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sjplimp
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sjplimp
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sjplimp
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4506 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-08-19 16:01:18 +00:00 |
sjplimp
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c85e34a881
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4503 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-08-19 14:52:25 +00:00 |
sjplimp
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bfa08f5781
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4502 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-08-17 22:26:34 +00:00 |