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2b2bc64ad9
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Merge pull request #3178 from akohlmey/sphinx-theme-update
Update LAMMPS theme for HTML pages of the manual
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2022-03-18 18:09:56 -04:00 |
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364ac40724
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Merge pull request #3169 from stanmoore1/kk_reduce_mem
Reduce memory use in Kokkos package
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2022-03-18 14:21:30 -04:00 |
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008c000bfe
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update LAMMPS theme for HTML pages from readthedocs theme to version 1.0.0
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2022-03-18 07:44:47 -04:00 |
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9e91708e27
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Merge pull request #3174 from akohlmey/collected-small-changes
Collected small changes
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2022-03-16 16:20:28 -04:00 |
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6d070c7043
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more use of modernized APIs
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2022-03-16 15:24:42 -04:00 |
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7e2fef096f
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use accessor function to get and process list of fixes
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2022-03-16 14:18:09 -04:00 |
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31bc7b2864
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Merge pull request #3170 from akohlmey/auto-load-plugins
Automatically load LAMMPS plugins if they are in folders listed in LAMMPS_PLUGIN_PATH environment variable
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2022-03-16 13:53:14 -04:00 |
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4be3da727a
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include tools/python in whitespace check
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2022-03-16 13:22:39 -04:00 |
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bb4268518b
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make python 2 compatible
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2022-03-16 12:56:19 -04:00 |
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72425f1874
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add '#' to make the list of headers a comment
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2022-03-16 12:55:53 -04:00 |
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b774464156
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whitespace
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2022-03-16 12:55:25 -04:00 |
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ba19090631
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Merge pull request #3173 from athomps/snap-inner
Inner cutoff switching function for SNAP descriptors and potentials
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2022-03-16 12:43:23 -04:00 |
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4894263215
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Merge pull request #3167 from CDenniston/develop
Update LATBOLTZ package to new version
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2022-03-16 12:22:48 -04:00 |
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e3d4e80407
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Merge branch 'develop' into collected-small-changes
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2022-03-16 11:55:07 -04:00 |
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0fd02ffd10
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Merge pull request #3153 from aliehlen/log-pizza-updates
Log pizza updates
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2022-03-16 11:50:31 -04:00 |
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49b87f9929
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enable/apply clang-format, remove redundant code, style fixes
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2022-03-16 09:07:38 -04:00 |
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edf7c274b9
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Merge branch 'lj_cubic_error' of github.com:olavgal/lammps into collected-small-changes
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2022-03-16 09:03:02 -04:00 |
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92bfaeda10
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fix bug where it was not possible to use an absolute path for write_coeff
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2022-03-16 09:00:56 -04:00 |
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0ac5d8223d
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Whitespace
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2022-03-16 13:06:32 +01:00 |
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8ac1d5bbc5
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Error fixed. Epsilon and sigma must also be symmetric
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2022-03-16 13:04:36 +01:00 |
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8e585620c3
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enable and apply clang-format
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2022-03-14 17:14:40 -04:00 |
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ec97d859b9
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use tokenizer class for parsing
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2022-03-14 17:14:01 -04:00 |
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1d1dea56d8
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whitespace and programming style fixes
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2022-03-14 16:52:58 -04:00 |
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43e486973f
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cosmetic changes. remove debug comments and commented out code.
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2022-03-14 14:40:38 -04:00 |
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87429366f8
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update plugin developer guide
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2022-03-14 09:54:31 -04:00 |
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46564c1ee8
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recover compilation on windows
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2022-03-12 18:43:53 -05:00 |
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0778c12f04
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plug memory leaks by freeing MPI data types
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2022-03-12 18:06:01 -05:00 |
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ddb35ee455
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use utils::logmesg and fmtlib. remove use of sprintf() to temporary buffers
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2022-03-12 18:05:05 -05:00 |
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484b7e6d33
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must remove and respecify fix lb/fluid around reset_timestep command
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2022-03-12 16:16:15 -05:00 |
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fe9b426c7e
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cosmetic changes
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2022-03-12 16:14:55 -05:00 |
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9931323463
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attempt to transparently download the missing data file with curl
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2022-03-12 14:03:08 -05:00 |
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293ad3fc03
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move lb/fluid pointer initialization to initializer list
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2022-03-12 12:03:18 -05:00 |
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4948438265
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fix small typesetting issues
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2022-03-12 09:53:50 -05:00 |
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a66228b4d2
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make sure pointer is null on first use
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2022-03-12 09:42:03 -05:00 |
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aca7126cfe
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use newer APIs to access list of fixes in Modify class
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2022-03-12 09:23:36 -05:00 |
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7e2bb9a065
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reformat and spellcheck the documentation
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2022-03-12 08:43:17 -05:00 |
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0341599390
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fixes were removed from package, remove from the documentation as well
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2022-03-12 08:31:00 -05:00 |
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335e7c7bbc
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replace use of iostreams and stringstreams with stdio and fmtlib
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2022-03-12 08:25:56 -05:00 |
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4c090c5d8e
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remove debug comments
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2022-03-12 08:24:51 -05:00 |
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84a7596b7c
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more closely follow LAMMPS programming style conventions
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2022-03-12 08:23:40 -05:00 |
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25b4d8ade1
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move static constants to its own header that is only pulled in by files that use them.
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2022-03-12 08:21:52 -05:00 |
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b27cbbd1a1
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Merge branch 'develop' into CDenniston/develop
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2022-03-12 07:28:30 -05:00 |
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aaeb9fe933
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Merge branch 'dielectric-updates' of github.com:ndtrung81/lammps into collected-small-changes
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2022-03-12 07:26:00 -05:00 |
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b1119d81a9
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Minor tweaks
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2022-03-11 21:25:44 -07:00 |
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014345a512
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Updated a citation
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2022-03-11 20:55:59 -07:00 |
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51034c00c0
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Completed documentation
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2022-03-11 20:40:18 -07:00 |
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b9fd86e7ca
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switchinnerflag working for single-element two types SNAP potential
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2022-03-11 17:23:38 -07:00 |
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f691805062
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More
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2022-03-11 16:41:22 -07:00 |
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5216a543ae
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More
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2022-03-11 15:43:48 -07:00 |
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4d13282120
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More
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2022-03-11 15:07:18 -07:00 |
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