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1aa8b64283
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convert GPU package styles to use new neighbor list request API
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2022-03-08 04:37:46 -05:00 |
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a06c4767a0
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Merge branch 'upstream' into gpu-newton-pair-on
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2021-11-20 08:30:39 -06:00 |
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766f975b74
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Removed the newton checks in the gpu pair styles; reverted to mixed precision in Makefile.cuda
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2021-11-13 07:00:12 -06:00 |
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8b36061db4
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replace MPI_Wtime() with platform::walltime()
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2021-10-05 22:53:39 -04:00 |
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0904ffa813
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Enabled newton pair on for gpu pair styles
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2021-08-06 01:11:31 -05:00 |
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76a472d8b8
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Merge pull request #2640 from ndtrung81/eam-gpu
Fixing bugs on eam*/gpu for pair hybrid with neigh yes, where the gpu…
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2021-05-27 12:11:13 -04:00 |
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09c19a936b
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update URLs in source code and manual
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2021-05-24 14:18:20 -04:00 |
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7a17780a82
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consistently check for newton pair off and align error message rest of LAMMPS
also add checks for required charge property for pair styles with coulomb
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2021-05-22 13:17:58 -04:00 |
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d1941392d3
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disable clang-format for all existing .cpp files (for now)
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2021-05-05 23:53:38 -04:00 |
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4738337e47
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update/trim list of include files according to the IWYU principle
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2021-04-24 13:22:39 -04:00 |
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8c4918457f
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consistently compare atom->molecular against enumerator constants
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2021-03-14 01:25:22 -05:00 |
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e7e2d2323b
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Feb2021 GPU Package Update - GPU Package Files
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2021-02-15 08:20:50 -08:00 |
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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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6113169a47
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IWYU based include statement cleanup
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2020-09-02 17:39:34 -04:00 |
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229203bac0
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Supported neighbor list builds for triclinic boxes on the GPU
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2020-05-06 08:51:17 -05:00 |
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f073a64549
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add suffix_flag settings to GPU package styles
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2020-01-10 15:29:53 -05:00 |
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5b3a15bd94
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putting implementation header first in package folder sources
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2019-07-03 19:58:25 -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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b417cfda9b
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removed dead code and reduce compiler warnings about unused parameters
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2019-02-03 11:36:41 -05:00 |
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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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8366b35459
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15247 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2016-07-01 23:25:50 +00:00 |
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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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01004c314a
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13927 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-08-20 18:59:20 +00:00 |
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