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accf90afb6
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add example for gauss/diel pair style.
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2010-05-21 18:55:20 -04:00 |
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24588aa6e3
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Merge branch 'master' into lammps-icms
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2010-05-15 11:45:24 -04:00 |
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cca0a504ae
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Added charge values to dump output.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4132 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-05-14 16:40:49 +00:00 |
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4fdcc90c60
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Merge branch 'master' into lammps-icms
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2010-05-13 08:26:22 -04:00 |
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f9decb8290
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elastic constants example
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4124 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-05-12 03:25:58 +00:00 |
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c36b939135
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Merge branch 'thread-support' into lammps-icms
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2010-05-08 11:55:33 -04:00 |
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7071a33152
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add example input for OpenMP enable CHARMM pair style.
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2010-05-05 23:14:48 -04:00 |
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ae6110048f
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Merge branch 'imd-improvements' into lammps-icms
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2010-04-29 12:14:13 -04:00 |
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be85e64b51
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ignore default log files.
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2010-04-29 10:00:58 -04:00 |
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cf2de48a09
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correct example input files so that they work with
the new fix npt scheme in LAMMPS.
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2010-04-29 09:59:40 -04:00 |
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6f67582c9c
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a few more input variants to test.
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2010-04-29 09:46:41 -04:00 |
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c4b487a9fe
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increased problem set size in melt demo.
rebuild log files.
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2010-04-28 21:36:23 -04:00 |
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0409125c46
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added log file from successful runs on regular and
threaded style input input on normal and threaded code.
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2010-04-28 19:35:24 -04:00 |
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e7cf9761fb
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added a version of the lj/cut pair style that is
derived from PairOMP instead of Pair. no threading
implemented yet. added some example for comparing
lj/cut to lj/cut/omp.
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2010-04-28 17:51:37 -04:00 |
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ffb6bd7271
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Update fix nvt examples
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3978 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-04-09 22:12:15 +00:00 |
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6767d117e2
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3964 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-04-07 19:42:25 +00:00 |
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9921249796
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Final changes to fix_box_relax and fix_nh
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3959 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-04-07 18:33:22 +00:00 |
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e152796332
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3955 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-04-02 17:26:17 +00:00 |
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b285c11726
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3952 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-04-02 16:59:55 +00:00 |
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e00095d335
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3871 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-03-03 18:40:02 +00:00 |
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6534fc5452
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Remove Strachan reference in header
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3814 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-02-19 19:04:10 +00:00 |
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5ce854b780
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Updated prd documentation
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3782 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-02-04 02:29:43 +00:00 |
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6e8ccfb7f9
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3692 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-01-14 23:34:19 +00:00 |
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2e51680815
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3691 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-01-14 23:33:28 +00:00 |
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8626f1cee6
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3688 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-01-14 21:38:16 +00:00 |
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fb584674c9
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3321 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-11-06 15:39:33 +00:00 |
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a2a7fd006c
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3260 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-10-30 18:26:00 +00:00 |
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d735ac6009
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3254 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-10-29 22:48:48 +00:00 |
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9ac1894090
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3252 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-10-29 22:46:06 +00:00 |
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651d00d18c
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3169 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-09-24 16:32:26 +00:00 |
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59905ad99a
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2975 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-07-02 22:30:53 +00:00 |
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f4cc5550f7
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2966 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-07-02 20:23:49 +00:00 |
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0af34f0968
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2963 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-07-02 19:39:27 +00:00 |
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676959e910
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2962 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-07-02 19:38:41 +00:00 |
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4b5e390775
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Removed Si from ffield.reax
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2876 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-06-09 19:19:29 +00:00 |
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1293b29453
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Added Strachan reference.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2834 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-06-01 20:16:04 +00:00 |
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06396c8958
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2821 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-05-19 14:58:16 +00:00 |
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883b5ae3a7
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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
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2009-04-30 17:01:34 +00:00 |
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4345f327b5
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2751 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-04-13 14:27:56 +00:00 |
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aef5044d66
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2583 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-02-12 21:03:10 +00:00 |
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c8632d65c6
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2366 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-01-09 22:18:56 +00:00 |
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8f6991985a
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2355 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-01-08 23:18:50 +00:00 |
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6579712aa8
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2336 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-01-06 17:12:05 +00:00 |
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41378c5f25
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2020 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2008-08-01 16:25:41 +00:00 |
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314b2f43d9
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1970 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2008-07-25 14:47:38 +00:00 |
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3f9a5f139d
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1847 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2008-05-17 22:16:54 +00:00 |
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07ed5774a3
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1839 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2008-05-16 21:57:36 +00:00 |
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c16b5e6b9d
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1836 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2008-05-16 20:39:25 +00:00 |
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23b15a6bed
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1748 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2008-04-14 22:19:42 +00:00 |
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c34f2d22fa
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1625 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2008-03-18 21:46:17 +00:00 |
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