Commit Graph

9534 Commits

Author SHA1 Message Date
1860c2d764 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14307 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-12-09 15:41:43 +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
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
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
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
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
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
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
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
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
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
4c19f60606 Fixed uninitialized variable for multiple molecule in set
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14249 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-11 23:37:31 +00:00
a61df922c3 got rid of std:complex_literals i1
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14248 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-10 16:47:09 +00:00
6d6d8345bf git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14245 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-11-07 21:07:07 +00:00
b741a77712 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14243 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-11-07 21:03:31 +00:00
fa9af07140 Added hexatic bond orientational order parameter
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14237 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-05 06:58:13 +00:00
3bc7350704 Added hexatic bond orientational order parameter
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14236 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-05 06:53:08 +00:00
4f71701e4e Added hexatic bond orientational order parameter
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14234 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-05 01:33:46 +00:00
a91bbaf7f2 Added hexatic bond orientational order parameter
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14233 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-04 23:56:47 +00:00
f227080d70 Added hexatic bond orientational order parameter
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14231 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-11-04 05:18:21 +00:00
34e1f5c71e git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14227 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-30 23:45:50 +00:00
a2481116c5 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14225 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-30 22:52:45 +00:00
260d9f4192 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14221 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-30 20:14:54 +00:00
354e20f431 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14220 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-30 20:04:06 +00:00
628190cbcb git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14215 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-30 14:52:43 +00:00
0035a690d1 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14207 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-23 19:46:50 +00:00
ff974eb077 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14200 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-23 17:16:31 +00:00
08157510b7 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14197 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-23 17:00:52 +00:00
e53f61a869 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14196 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-23 14:53:22 +00:00
021a327e85 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14191 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-23 00:46:10 +00:00
9057c42350 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14187 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-23 00:30:53 +00:00
b45a8bb7e3 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14180 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-23 00:04:22 +00:00
9cf48b9349 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14176 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-22 23:41:19 +00:00
d815b390ba git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14175 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-22 23:39:46 +00:00
cfbe572aa5 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14173 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-22 23:03:43 +00:00
0eb2e8f9cb git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14172 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-22 22:56:21 +00:00