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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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cef100991f
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add utils::logical() function to complement the *numeric() functions
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2021-09-16 17:52:51 -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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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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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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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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72193bf877
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simplify/modernize
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2021-09-16 00:11:44 -04:00 |
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707d9f0ad2
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use correct data type for MPI calls
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2021-09-16 00:11:16 -04:00 |
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94f83c172a
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simplify and modernize code a little
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2021-09-15 23:15:14 -04:00 |
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1f1029486a
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fix small bug
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2021-09-15 20:13:54 -04:00 |
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7196a295a6
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small tweaks from static code analysis
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2021-09-15 19:50:52 -04:00 |
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fbd0fd7727
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fix typo
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2021-09-15 17:23:20 -04:00 |
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36b3ee32a4
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simplify
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2021-09-15 16:46:33 -04:00 |
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1adbd5f667
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Fix remaining issues
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2021-09-15 14:32:00 -06:00 |
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3caa066c28
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simplify/optimize code
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2021-09-15 16:23:07 -04:00 |
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a8220a8502
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cosmetic changes
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2021-09-15 16:08:53 -04:00 |
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7d92d665e8
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use explicit scoping when virtual dispatch is not available.
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2021-09-15 16:08:17 -04:00 |
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65d8f7f964
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use cmath header instead of math.h
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2021-09-15 15:25:58 -04:00 |
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1fdba7280e
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small optimization
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2021-09-15 15:14:52 -04:00 |
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f01681eae7
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use symbolic constant
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2021-09-15 15:09:58 -04:00 |
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9c301822fd
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use nullptr
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2021-09-15 14:57:10 -04:00 |
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eb80102871
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spelling
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2021-09-15 13:51:31 -04:00 |
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e1b76df161
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replace if with switch statement which is more efficient here
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2021-09-15 07:08:02 -05:00 |
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c63d6ce790
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minor update
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2021-09-15 07:07:48 -05:00 |
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6873001fec
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minor update, use string for comparison
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2021-09-15 07:07:23 -05:00 |
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c858703156
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Remove unused variables
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2021-09-14 20:20:09 -06:00 |
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1b91bfbfa1
|
spelling
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2021-09-14 17:17:46 -04:00 |
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19bc606a20
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fix typo
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2021-09-14 16:26:38 -04:00 |
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254dcdf665
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include formatting updates for the KOKKOS files as well
|
2021-09-14 16:23:48 -04:00 |
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86578554bb
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apply latest formatting conventions (w/o clang format on the .cpp file)
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2021-09-14 15:34:28 -04:00 |
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51cfbaa2ef
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Remove tabs
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2021-09-14 10:56:03 -06:00 |
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2b17796d73
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Switch max
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2021-09-14 10:23:57 -06:00 |
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f9236fbb33
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Remove unused variable
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2021-09-14 10:06:51 -06:00 |
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15c7792c33
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Fix issues with Kokkos package when ranks have zero atoms
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2021-09-14 10:02:29 -06:00 |
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b1092cfa4e
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detect C++20 standard
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2021-09-14 11:56:43 -04:00 |
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fa3c29dda6
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Merge branch 'master' of github.com:lammps/lammps into acks2_release
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2021-09-14 08:41:23 -06:00 |
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c8170c3388
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fix mingw 32-bit vs 64-bit craziness
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2021-09-13 10:14:34 -04:00 |
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80f95e5087
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step version strings for next patch release
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2021-09-13 07:33:34 -04:00 |
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ede3762e84
|
detect a few more compilers
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2021-09-13 00:29:04 -04:00 |
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0202b1169a
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Minor edits to the error message
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2021-09-12 23:08:36 -05:00 |
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