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7f034b2ef7
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replace replicated Dihedral/Improper problem warning with function in base class
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2021-05-05 16:54:40 -04:00 |
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9f4da1128b
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remove optional logflag argument from Error::message() and Error::warning()
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2021-05-05 16:02:51 -04:00 |
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adf74b3a22
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use https://lammps.sandia.gov based URLs consistently
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2020-10-21 16:45:30 -04:00 |
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fc3d9fee5e
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more USER-OMP updates
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2020-09-04 01:32:52 -04:00 |
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0bedebc083
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migrate omp constructs to new macros
These changes were automatically generated using the script
posted in https://github.com/lammps/lammps/pull/1651#issuecomment-525814475
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2020-03-20 12:47:03 -04:00 |
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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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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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c7af948dfc
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use ev_init for impropers
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2019-03-13 17:50:50 +01:00 |
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6702f65fbb
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Fix mistake in virial calculation for improper_fourier and improper_umbrella
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2019-01-15 10:06:42 +01:00 |
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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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887981cfaa
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bugfix for virial tally for improper style umbrella from Steven Vandenbrande (U Gent)
this closes #182
(cherry picked from commit 4921dc18a0)
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2016-10-06 17:20:22 -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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9a878cdd67
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14128 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-10-21 18:29:37 +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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823675d6be
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11416 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2014-01-31 14:46:30 +00:00 |
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2a67f644a8
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9720 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-04-01 15:50:18 +00:00 |
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4ff021e8f4
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9542 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-02-20 15:21:22 +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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e8ff810ee7
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8391 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2012-06-25 16:42:20 +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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2e686fb6ca
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7859 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2012-02-28 19:59:30 +00:00 |
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57a20c2706
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7265 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2011-12-01 17:05:34 +00:00 |
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