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4ec07422f0
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avoid division by zero when using cutoff 0.0 with pair_modify shift yes
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2017-07-14 23:33:00 -04:00 |
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51fc386e72
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correct the inner loop range for resetting cutoffs when redefining a pair style
this was reported by frank uhlig on lammps-users for lj/cut, but it applies to many more pair styles
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2017-05-16 00:26:18 -04:00 |
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1cd4c48ccc
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new SNAP potential for W
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2017-02-21 15:49:21 -07:00 |
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3f46b6d782
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fix bugs from incorrect code synchronization
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2017-01-16 11:15:54 -05:00 |
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5abd6e5122
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reordering operations in Pair::init_style() to avoid segfaults w/o a kspace style
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2017-01-16 11:08:48 -05:00 |
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f0131393e0
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Merge pull request #248 from akohlmey/collected-small-fixes
collected small bugfixes and updates
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2016-11-04 10:58:42 -06:00 |
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782a328080
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avoid memory leaks when using kspace solvers for lennard-jones
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2016-11-01 14:55:13 -04:00 |
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35753b8f08
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add error location propagation to force->bounds() and force->boundsbig()
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2016-10-26 15:53:02 -04:00 |
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354e20f431
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14220 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-10-30 20:04:06 +00:00 |
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4a975dd8cf
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12957 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-01-19 23:49:20 +00:00 |
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74be71df0b
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11267 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-01-20 23:54:27 +00:00 |
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8ff753d958
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11044 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-11-22 17:14:39 +00:00 |
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2dbe3f80a2
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10103 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-06-27 20:02:55 +00:00 |
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a289ce92d7
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9701 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-21 17:36:09 +00:00 |
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040cedbe5a
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9687 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-14 16:34:11 +00:00 |
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a5c6bfb1c5
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9566 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-04 23:09:29 +00:00 |
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79410e394f
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9509 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-02-15 17:32:15 +00:00 |
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7a286596d8
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9416 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-02-08 21:38:50 +00:00 |
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0b10887ad4
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Changes to coulomb tables.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8973 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2012-10-17 23:27:34 +00:00 |
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e27125f93e
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8908 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2012-10-05 15:21:35 +00:00 |
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64672be150
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8886 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2012-10-03 15:03:45 +00:00 |
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