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dc241abb85
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Merge pull request #2305 from akohlmey/next_patch_version
Update version strings for updated patch release
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2020-08-24 13:46:50 -04:00 |
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f18d0507b3
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fix issues with lj/long pair styles when not using long-range for dispersion
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2020-08-22 22:54:38 -04:00 |
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2907a10937
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update version strings for new attempt for a patch release
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2020-08-22 16:42:39 -04:00 |
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9152a8e98f
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avoid division by zero in imaging code
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2020-08-22 15:32:04 -04:00 |
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2fd654f4fd
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silence compiler warnings about unused variables
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2020-08-22 15:06:00 -04:00 |
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86153a0f77
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avoid division by zero in MathExtra normalize functions
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2020-08-22 15:03:27 -04:00 |
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2a6546d6f0
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Merge pull request #2296 from akohlmey/next_patch_version
Update version strings for next patch release
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2020-08-21 14:43:56 -04:00 |
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e0c74a30bc
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Fix MV2 env variable
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2020-08-21 11:08:49 -06:00 |
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7f87ccccc8
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Merge branch 'collected-small-changes' into next_patch_version
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2020-08-21 11:18:10 -04:00 |
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4c46119a48
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Merge pull request #2280 from lammps/gridcomm-tiled
Support for tiled decompositions in PPPM
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2020-08-21 00:16:20 -04:00 |
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3183af9b85
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fix a few more initialization issues in pppm/disp and pppm/disp/intel
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2020-08-20 23:42:00 -04:00 |
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2855f04363
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tweak output format
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2020-08-20 23:41:32 -04:00 |
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deb24626d1
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fix gc vs. gc6 issues in fix pppm/disp
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2020-08-20 22:45:37 -04:00 |
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0440b13a6d
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fix memory leaks
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2020-08-20 22:27:15 -04:00 |
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17a9612126
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fix pppm/disp initialization issues
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2020-08-20 22:17:32 -04:00 |
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0a042be6b8
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fix another pppm/disp bug for dispersion-only runs
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2020-08-20 22:11:06 -04:00 |
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e7639d4951
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Merge pull request #2297 from akohlmey/more-fix-tests
Add a few more unit tests for fixes and fix some issues related to it
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2020-08-20 20:18:09 -04:00 |
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287112761c
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tweak load balancing output format
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2020-08-20 18:51:28 -04:00 |
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398e929400
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Merge branch 'master' into gridcomm-tiled
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2020-08-20 17:58:35 -04:00 |
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4fde9022a3
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remove tabs
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2020-08-20 17:54:26 -04:00 |
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203ab71b62
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Merge branch 'master' into gridcomm-tiled
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2020-08-20 17:00:55 -04:00 |
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c513b60f97
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Merge branch 'reduce-kokkos-compiler-warnings' of github.com:akohlmey/lammps into reduce-kokkos-compiler-warnings
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2020-08-20 16:59:46 -04:00 |
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f3b0bf8a33
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Merge branch 'master' into reduce-kokkos-compiler-warnings
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2020-08-20 16:59:31 -04:00 |
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cd7ba1d007
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Merge branch 'master' into more-fix-tests
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2020-08-20 16:41:29 -04:00 |
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f0335fabb1
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Merge pull request #2295 from akohlmey/add-fix-momentum-chunk
Add fix momentum/chunk
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2020-08-20 16:40:51 -04:00 |
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d6b19b80d0
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Make all Kokkos functors structs
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2020-08-20 13:52:53 -06:00 |
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17b998edb3
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fix whitespace issue
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2020-08-20 15:51:41 -04:00 |
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92622d9079
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add restart support to fix temp/rescale, fix spring/chunk, and fix spring/rg
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2020-08-20 15:32:10 -04:00 |
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ff2242385b
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Tweak format
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2020-08-20 12:56:56 -06:00 |
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6862d70759
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Merge branch 'master' of github.com:lammps/lammps into reduce-kokkos-compiler-warnings
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2020-08-20 11:24:30 -06:00 |
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6efc51d863
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Update comment
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2020-08-20 11:19:34 -06:00 |
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394b2da585
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Port changes to Kokkos
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2020-08-20 11:09:21 -06:00 |
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0f11532162
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remove class member that was incorrectly shadowing a base class member
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2020-08-20 10:10:03 -04:00 |
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6bda49e8d8
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step version strings for next patch release
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2020-08-20 07:46:01 -04:00 |
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ed26d8ef8f
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revert change to fft3d.cpp that breaks all PPPM styles
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2020-08-19 20:24:03 -04:00 |
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2ed18bb841
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tweak output format
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2020-08-19 20:15:00 -04:00 |
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2feccc2837
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fix dispersion gridcomm buffer bug
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2020-08-19 20:12:43 -04:00 |
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729b3d2717
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major whitespace cleanup
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2020-08-19 18:46:35 -04:00 |
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503d3826bb
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Merge branch 'master' into gridcomm-tiled
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2020-08-19 18:36:49 -04:00 |
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fdb1e69768
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silence compiler warnings
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2020-08-19 18:36:28 -04:00 |
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284cdceae8
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silence compiler warnings
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2020-08-19 18:19:28 -04:00 |
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ba06a7bf0c
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final gridcomm comments and flip FFT forward/reverse
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2020-08-19 16:05:30 -06:00 |
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8f156bfee6
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Fix typo in pppm_gpu.cpp
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2020-08-19 14:25:06 -06:00 |
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6f37da4eb2
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Whitespace cleanup
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2020-08-19 14:10:35 -06:00 |
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5ea7ca94f4
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Revert accidental change
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2020-08-19 13:54:06 -06:00 |
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073c7ee138
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Fix warnings related to virtual function override
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2020-08-19 13:29:11 -06:00 |
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af50d90b55
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add author to README
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2020-08-19 15:15:28 -04:00 |
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a0aca4cee4
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improve error message
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2020-08-19 15:08:04 -04:00 |
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b4ce4a0979
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must delete internal computes if they already exist (e.g. after a restart)
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2020-08-19 15:07:56 -04:00 |
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cc0d294478
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Fix segfault
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2020-08-19 13:05:23 -06:00 |
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