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d89e6f6765
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do not downgrade C++ standard when adding the KOKKOS package
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2021-09-21 23:52:49 -04:00 |
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ce05ed15c1
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adjust for compatibility with C++20 compilers
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2021-09-21 23:52:30 -04:00 |
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f2aacca803
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modernize and fix some memory leaks
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2021-09-21 22:03:38 -04:00 |
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afccf1933f
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correctly specify the destructor function name.
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2021-09-20 23:40:14 -04:00 |
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8d8c710982
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Merge pull request #2942 from akohlmey/next_patch_release
Step version strings for the next patch release
patch_20Sep2021
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2021-09-20 20:35:23 -04:00 |
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9a2c2b5fe3
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Merge pull request #2941 from akohlmey/collected-small-changes
Large collection of updates and bugfixes for the stable release
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2021-09-20 16:49:00 -04:00 |
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f340e15587
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update version strings
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2021-09-20 16:26:47 -04:00 |
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c39d3057dc
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insert missing atom-ID
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2021-09-20 16:14:18 -04:00 |
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b73c9280c9
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improve error message
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2021-09-20 13:58:48 -04:00 |
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5ff881fb0d
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Change "offsite" to "external" to correct broken URLs to lammps.org
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2021-09-20 12:05:52 -04:00 |
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22d7ce564a
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fix typo
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2021-09-20 07:29:10 -04:00 |
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f80df9ae41
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a few more (final?) IWYU updates
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2021-09-19 09:41:23 -04:00 |
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4fcf343227
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fix typo
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2021-09-18 21:59:31 -04:00 |
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3cab58bffe
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small correction
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2021-09-18 21:34:30 -04:00 |
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12406b90a1
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more iwyu header updates
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2021-09-18 21:24:01 -04:00 |
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579f08bbbc
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add support for compilation of OpenCL loader on FreeBSD
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2021-09-18 19:04:08 -04:00 |
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c0a910a6c5
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expand mapping to handle "style_*.h" header files correctly.
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2021-09-18 16:37:06 -04:00 |
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2b3a09ac88
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a few remaining updates to include statements
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2021-09-18 16:36:44 -04:00 |
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2382d6c71d
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handle changes in GAP repo
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2021-09-18 16:36:18 -04:00 |
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bca99f684f
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update list and order of include files from include-what-you-use analysis
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2021-09-18 14:16:48 -04:00 |
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db76edbade
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implement utils::current_date() convenience function to reduce replicated code
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2021-09-18 09:05:35 -04:00 |
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5a6c1abeed
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dead code removal
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2021-09-17 22:53:59 -04:00 |
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a46b8688ea
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apply fix from balance command to fix balance
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2021-09-17 22:52:58 -04:00 |
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cb2de211b2
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small corrections
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2021-09-17 22:52:13 -04:00 |
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a71b77c06e
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simplify. use utils::strdup() more.
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2021-09-17 22:51:59 -04:00 |
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385220fd4b
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format changes
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2021-09-17 22:50:15 -04:00 |
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cd3efc3fa8
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initialize all members
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2021-09-17 22:45:26 -04:00 |
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ffeeb2f977
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simplify
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2021-09-17 19:54:55 -04:00 |
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e6fb0e3bd8
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small tweaks
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2021-09-17 16:51:37 -04:00 |
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3046c9ca93
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include EXTRA-DUMP in "most"
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2021-09-16 23:01:42 -04:00 |
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dc49917412
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remove unused variable
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2021-09-16 22:58:42 -04:00 |
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5bddddcd7a
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revert modernization change (for now)
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2021-09-16 22:57:14 -04:00 |
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5c14825d69
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Add stable link in docs
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2021-09-16 18:13:41 -04:00 |
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5bbec337e5
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provide more comprehensive suggestions for GPU neighbor list errors
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2021-09-16 10:23:44 -04:00 |
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0fcc10b635
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fix typo
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2021-09-16 10:18:49 -04:00 |
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e82a2a3280
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enforce initialization and thus silence compiler warnings
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2021-09-16 07:58:21 -04:00 |
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75f2eb604d
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remove redundant code: all struct members are initialized to defaults in the constructor
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2021-09-16 07:45:33 -04:00 |
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5411075cc6
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modernize
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2021-09-16 07:44:27 -04:00 |
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90225153d9
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make sure err_flag is initialized
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2021-09-16 07:33:34 -04:00 |
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00e396c921
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move misplaced #endif and make code more readable
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2021-09-16 07:33:24 -04:00 |
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353b3a2bb3
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reformat for increased readability
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2021-09-16 07:25:04 -04:00 |
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dc50db0675
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use explicit scoping when virtual dispatch is not (yet) available
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2021-09-16 01:01:38 -04:00 |
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1fd25071b9
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modernize
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2021-09-16 01:01:19 -04:00 |
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ef8a0e5005
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removed dead code, reformat
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2021-09-16 00:55:30 -04:00 |
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761e519a15
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simplify
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2021-09-16 00:55:02 -04:00 |
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a47df02f79
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modernize
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2021-09-16 00:54:46 -04:00 |
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c83ad07740
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simplify
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2021-09-16 00:27:16 -04:00 |
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2c945f6753
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small performance optimization for pair style comb
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2021-09-16 00:26:53 -04:00 |
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7aa6241db5
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about 1.5x speedup for pair style comb3 by using MathSpecial::powint()
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2021-09-16 00:13:28 -04:00 |
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2b6ff442d8
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remove dead code
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2021-09-16 00:11:53 -04:00 |
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