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e44c394680
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pairwise -> two-body for clarity in appropriate comments
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2019-11-13 19:48:52 +09:00 |
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6b94126f67
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change flag name in pair.h: cntratmstressflag -> centroidstressflag
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2019-11-13 18:37:48 +09:00 |
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0a64dff132
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add initial support to centroid virial in USER-OMP pair styles
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2019-11-11 23:27:10 +09:00 |
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f4a07cf24e
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update USER-OMP to compute per-atom virial for pairs when vflag=8
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2019-10-08 16:11:58 +09:00 |
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7bd296919e
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update USER-OMP to compute per-atom centroid virial for impropers when vflag=8
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2019-10-08 14:55:26 +09:00 |
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a368f4ee29
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update USER-OMP to compute per-atom centroid virial for dihedrals when vflag=8
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2019-10-08 14:55:20 +09:00 |
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20b44f2427
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update USER-OMP to compute per-atom centroid virial for angles when vflag=8
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2019-10-08 14:06:54 +09:00 |
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d401d07595
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v_tally9 helper function for adding arrays with 9 elements
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2019-10-04 19:39:23 +09:00 |
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ad6e5a82b0
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update USER-OMP to compute per-atom centroid virial for bonds when vflag=8
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2019-10-08 16:08:04 +09:00 |
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d2281503ca
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add centroid virial argument (cvatom) to ThrOMP::ev_setup_thr, and modify all related styles to pass a NULL pointer to pass compilation
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2019-10-04 19:14:05 +09:00 |
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b4f60ef477
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starting to work on includes in USER-OMP
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2019-07-11 22:12:01 -04:00 |
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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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8b7bd9d88e
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fix bug where per atom data for USER-OMP was reducing the wrong arrays with hybrid styles
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2017-01-26 14:59:10 -05:00 |
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0ffa50f8e8
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tweaked author syntax
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2016-11-22 08:15:13 -07:00 |
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5685131fe2
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add USER-OMP version of pair style agni
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2016-11-11 19:08:01 -05:00 |
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56ee1b670b
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14088 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-10-05 15:13:56 +00:00 |
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14554c93af
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Fixing compile error in USER-OMP
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13973 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-08-31 15:20:49 +00:00 |
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4e247c3b8c
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13951 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-08-28 23:36:43 +00:00 |
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ce59e32d1c
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13937 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-08-28 20:00:56 +00:00 |
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418e9cf0bb
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11306 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-01-24 21:43:20 +00:00 |
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cb1ad361fb
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11256 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-01-17 21:17:42 +00:00 |
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adb129fe99
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9581 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 16:44:43 +00:00 |
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a8cb638e76
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9443 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-02-11 15:35:40 +00:00 |
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6676724eee
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9404 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-02-08 16:57:12 +00:00 |
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b078dc5e0b
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9279 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-01-17 15:56:40 +00:00 |
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6dcb5fb23d
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9002 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2012-10-25 15:35:14 +00:00 |
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9a9291036d
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2012-10-02 20:00:06 +00:00 |
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fb6436ab4e
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8863 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2012-10-02 19:59:40 +00:00 |
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5e52200ad3
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8496 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2012-07-24 23:14:32 +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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61c4fa6ee0
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7907 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2012-03-05 15:31:20 +00:00 |
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4deb839d4b
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7881 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2012-03-02 15:41:18 +00:00 |
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f55b74a85f
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7804 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2012-02-16 16:13:15 +00:00 |
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2c42373bc8
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7644 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2012-02-01 16:07:44 +00:00 |
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650607a38b
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7323 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2011-12-08 23:18:19 +00:00 |
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3895849986
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7264 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2011-12-01 17:05:22 +00:00 |
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90a5d2b322
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7066 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2011-10-10 17:11:58 +00:00 |
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1d743442b3
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6816 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2011-08-25 19:21:40 +00:00 |
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