Commit Graph

4667 Commits

Author SHA1 Message Date
7b788ebd0e Added a fix to output ReaxFF bond-order information.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2798 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2009-04-30 21:46:49 +00:00
180f47525d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2795 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-30 20:59:46 +00:00
e08729c96f Created fix_reax_write_bonds
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2794 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2009-04-30 19:48:26 +00:00
883b5ae3a7 Added fix write/reax/bonds and reordered TATB atoms
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2793 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2009-04-30 17:01:34 +00:00
d11c29e95b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2791 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-30 16:53:21 +00:00
55ecf78cdc git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2790 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-30 16:53:04 +00:00
bbd7007b2e git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2789 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-29 17:41:26 +00:00
8af12f9e13 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2785 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-29 17:29:52 +00:00
a4d85b50ac git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2783 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-29 17:22:30 +00:00
d4991f42ec git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2782 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-29 17:19:57 +00:00
c0b782aaa2 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2781 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-29 16:54:14 +00:00
16ef076c31 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2780 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-29 16:54:06 +00:00
8515f83a1c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2777 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-28 19:50:15 +00:00
1904459e45 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2776 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-28 19:46:52 +00:00
2dacebfcd0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2775 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-28 14:56:27 +00:00
00efe14d6d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2774 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-28 14:51:48 +00:00
70e7709d2e git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2773 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-22 23:33:07 +00:00
2391d7655a git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2765 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-16 14:32:03 +00:00
b3dacd6244 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2764 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-16 14:29:04 +00:00
9a737e4dbc git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2763 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-15 20:22:25 +00:00
4090c2c4c6 Corrected values of R for j!=k interactions
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2762 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2009-04-15 20:04:17 +00:00
15e329b328 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2760 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-15 15:17:44 +00:00
4c8102c10f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2757 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-15 13:10:59 +00:00
38f4cf5463 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2755 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-15 13:05:53 +00:00
b3884b1b57 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2752 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-13 14:33:02 +00:00
4345f327b5 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2751 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-13 14:27:56 +00:00
aea90e9b88 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2750 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-10 23:25:32 +00:00
721d689f93 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2748 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-10 23:20:41 +00:00
0d29a6db12 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2746 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-10 20:27:15 +00:00
16cfe5021d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2745 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-09 19:15:55 +00:00
3c70a07830 Added helpful comment
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2744 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2009-04-07 22:20:05 +00:00
f20bb5f76f Added helpful comment
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2743 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2009-04-07 22:19:08 +00:00
6bfaec3823 Added lib/meam/Makefile.tbird
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2742 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2009-04-07 22:09:50 +00:00
f33faa84ab Added lib/meam/Makefile.tbird
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2741 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2009-04-07 22:07:59 +00:00
1446033990 Added lib/reax/Makefile.tbird
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2740 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2009-04-07 22:05:34 +00:00
f20dfb1a6b Added lib/reax/Makefile.tbird
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2739 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2009-04-07 22:03:00 +00:00
287cb25182 Added lib/meam/Makefile.tbird
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2738 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2009-04-07 21:59:58 +00:00
5c01312855 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2737 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-06 21:26:59 +00:00
3d03e6c7a1 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2735 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-06 21:03:10 +00:00
03e8bd4fb2 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2734 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-06 20:55:03 +00:00
e04c4fff7f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2731 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-06 20:34:43 +00:00
89b7c3a351 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2730 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-06 20:32:46 +00:00
a570406482 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2729 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-06 20:13:53 +00:00
0d895e0844 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2728 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-06 18:23:41 +00:00
9a491edd03 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2727 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-06 15:59:15 +00:00
ea615ff444 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2726 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-06 15:58:28 +00:00
3d1ba30578 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2724 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-04 15:24:33 +00:00
1e2677ae7c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2723 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-04 15:03:21 +00:00
6957ab3742 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2718 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-03 19:50:57 +00:00
90dacbb8a5 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2717 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-03 19:46:03 +00:00