Commit Graph

9664 Commits

Author SHA1 Message Date
d24d85da64 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14305 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-12-09 00:27:17 +00:00
f3dabd0dce git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14304 f3b2605a-c512-4ea7-a41b-209d697bcdaa r14304 2015-12-08 23:56:27 +00:00
ab3fa39cc2 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14302 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-12-08 23:52:11 +00:00
b13f9b8c67 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14301 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-12-08 23:52:08 +00:00
74a04c378d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14300 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-12-08 23:51:33 +00:00
2216401b98 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14299 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-12-08 23:46:58 +00:00
24da72836d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14298 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-12-08 23:35:27 +00:00
9f7fc76984 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14297 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-12-08 23:35:16 +00:00
eaa45f0b10 ''
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14295 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-08 23:34:01 +00:00
6000ad1bb7 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14294 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-12-08 23:28:35 +00:00
b73bfe968a ''
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14293 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-08 23:16:00 +00:00
d1cbced715 ''
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14292 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-08 23:15:41 +00:00
4da6cce1e9 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14291 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-12-08 23:15:20 +00:00
7e710a0fe3 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14290 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-12-08 23:13:17 +00:00
692047a65a Fixed error in one example command
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14289 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-08 16:12:04 +00:00
e028508845 Simplified non-overlap condition
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14288 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-05 03:33:47 +00:00
32acf72146 Simplified non-overlap condition
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14287 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-05 03:32:34 +00:00
9ae8b64f9a Cleaned up sna factorial table
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14286 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-05 03:31:39 +00:00
5087bdb20c prevented reorder from being used with fix gcmc
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14285 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-05 03:28:45 +00:00
f7702fd7e3 removed print statement
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14284 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-05 03:27:16 +00:00
2271d9168e Added missing normalization to vector case
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14283 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-04 21:56:45 +00:00
d241f928c8 Fixed error in average option
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14282 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-04 19:29:46 +00:00
050a1367a0 Fixed error in average option
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14281 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-04 19:29:27 +00:00
28e3ebfd10 Fixed error in average option
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14280 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-04 19:06:19 +00:00
853eab8917 Fixed problem in column_length(int)
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14279 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-03 22:57:01 +00:00
00738a8baa Added average keyword
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14278 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-02 05:06:52 +00:00
3ca986fc6a Fixed undefined tdof in setup
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14277 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-01 21:42:17 +00:00
e993934732 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14276 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-12-01 14:32:42 +00:00
7f02cecb78 Small change
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14275 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-25 21:22:45 +00:00
88f58beb97 Added latest changes from Albert Bartok
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14274 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-24 16:26:24 +00:00
574a328184 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14272 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-11-21 00:35:34 +00:00
355ba86d8b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14271 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-11-21 00:35:32 +00:00
b10ae0abaf git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14270 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-11-21 00:35:23 +00:00
b857237fef git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14269 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-11-19 15:34:38 +00:00
7189cdd80d ''
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14268 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-18 18:25:17 +00:00
0bdd0e36cc ''
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14267 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-18 18:25:02 +00:00
77f8955d4e git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14266 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-11-18 18:23:54 +00:00
f6c76f4623 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14265 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-11-18 18:23:45 +00:00
e3c4db746c ''
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14263 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-17 23:13:55 +00:00
61678ee8f2 ''
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14262 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-17 23:13:46 +00:00
f496b51d56 Changed the factorial table to static member
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14261 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-17 23:10:26 +00:00
d7e2bb3a62 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14259 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-11-17 21:43:53 +00:00
99c4b4cb22 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14258 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-11-17 21:43:50 +00:00
16a90f2bfc ''
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14256 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-17 21:42:53 +00:00
cd714e67a7 ''
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14255 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-17 21:42:36 +00:00
27798d4f4e Updated compute hexorder/atom, added compute orientorder/atom
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14254 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-16 23:14:35 +00:00
c28bd3c3ff Updated compute hexorder/atom, added compute orientorder/atom
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14253 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-16 22:37:40 +00:00
9dc8102ac4 Updated compute hexorder/atom, added compute orientorder/atom
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14252 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-16 17:45:59 +00:00
70aba85d31 Updated compute hexorder/atom, added compute orientorder/atom
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14251 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-15 22:34:00 +00:00
da1a3ac83a Fixed error in onemols initialization when gcmc uses non-first molecule template
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14250 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-11 23:39:25 +00:00