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381ac888c8
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initialize cut_respa to NULL in constructor to avoid uninitialized access
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2020-02-14 15:51:38 -05:00 |
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e2988c5c20
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refactor sfgets() and sfread() to both allow NULL filenames and guess from /proc if needed and possible
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2019-10-18 17:55:28 +02:00 |
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fe20490891
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more use of utils::sfread()
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2019-10-17 17:06:12 -04:00 |
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256531a29a
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put implementation header first for all remaining main folder source files
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2019-07-03 19:34:13 -04:00 |
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11708c8f96
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continue cleaning up include files based on IWYU
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2019-07-02 15:10:52 -04:00 |
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06a57dd659
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use ev_unset for all pair styles
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2019-03-13 17:49:16 +01:00 |
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e9bc939098
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Fix more unused parameter warnings (#1076)
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2018-08-23 12:22:44 -06:00 |
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e4071d7f46
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replace C-style include files with their C++ equivalents
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2018-04-27 18:00:24 -04:00 |
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0966e14e73
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more changes to rRESPA neighbor lists
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2017-10-17 17:33:01 -06:00 |
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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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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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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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aa33af4032
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10160 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-06-28 19:00:58 +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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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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ef9e700545
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8226 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2012-06-06 22:47:51 +00:00 |
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ab6e6d4ef1
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8197 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2012-05-30 21:59:21 +00:00 |
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f90ce18f3d
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7133 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2011-10-20 00:11:49 +00:00 |
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19e8c92a90
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7003 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2011-09-23 18:06:55 +00:00 |
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f62b317d37
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6452 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2011-06-20 16:42:39 +00:00 |
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147842df01
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6327 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2011-06-07 18:06:14 +00:00 |
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eb7d288360
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5896 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2011-04-05 19:10:43 +00:00 |
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fbb475b9cd
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5835 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2011-03-25 21:13:51 +00:00 |
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56f4081838
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4227 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-06-03 16:16:29 +00:00 |
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0bf07db002
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4211 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-06-01 14:49:56 +00:00 |
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6859720343
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3091 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-08-18 17:55:33 +00:00 |
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a265428940
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3039 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2009-08-10 20:16:47 +00:00 |
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