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5d02e140d4
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There is a wrong equation in the line490, MY_4PI should be MY_PI*zt
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2025-02-28 17:43:54 +08:00 |
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916e5a81fb
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more fix::init() checks and some clang-formatting for NH style classes
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2024-12-27 08:44:02 -05:00 |
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f637299ac5
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Added symmetrization of cutoff in init_one() and fixed a print
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2024-04-04 18:18:10 +02:00 |
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d39158ca08
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modernize
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2024-02-24 03:38:48 -05:00 |
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094d099699
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update author credits
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2024-02-05 10:11:01 -05:00 |
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12422ff510
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replace defines with static constexpr declarations
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2024-01-21 15:53:35 -05:00 |
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e5160b279a
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avoid static code analysis warnings
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2023-10-24 23:12:17 -04:00 |
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a6d178194e
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use consistent names and capitalization in comments
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2023-08-03 10:59:31 -04:00 |
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75f5130f5f
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add missing override
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2023-03-30 05:28:23 -04:00 |
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0d8623c3f2
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simplified logic from clang-tidy
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2023-03-26 21:33:37 -04:00 |
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7787734496
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move check for non-ellipsoid atoms to compute function so it is compatible with hybrid pair styles
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2023-03-26 17:28:18 -04:00 |
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6facb8d424
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use override instead of virtual as per style conventions
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2023-03-26 17:19:33 -04:00 |
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d7742412b3
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must use dynamic cast due to virtual inheritance
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2022-12-12 20:37:53 -05:00 |
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d53ce7aba9
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initialize pointer to null
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2022-11-09 11:15:18 +08:00 |
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3bfdc0aae9
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initialize pointer to null
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2022-10-27 17:05:55 -04:00 |
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fc59d7d3ca
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update LAMMPS developer contact info
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2022-10-24 18:28:12 -04:00 |
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34d70dd753
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Merge branch 'develop' into new-pair_style-ylz
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2022-10-24 18:27:24 -04:00 |
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2132b1d904
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update developer reference text
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2022-10-24 11:08:26 -04:00 |
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cccf3f6f78
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change email for contacting LAMMPS developers, add to homepage checker
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2022-10-20 20:36:03 -04:00 |
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d50bb3bffb
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minor tweak
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2022-10-18 15:45:56 -04:00 |
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45713e97d4
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require that all atoms are ellipsoids. will segfault or worse without
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2022-10-18 14:34:46 -04:00 |
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d7b436f833
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enable and apply clang-format,
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2022-10-18 14:34:23 -04:00 |
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39020379da
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fix permissions, error docs, URLs, whitespace
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2022-10-18 11:53:38 -04:00 |
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0b17654bee
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New pair-style ylz added to ASPHERE package
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2022-10-13 13:45:09 +08:00 |
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67f6adebb7
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whitespace fixup with dynamic casts
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2022-09-10 13:26:38 -04:00 |
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29e1595fb4
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Updates to BibTeX syntax for anything that needed it that I caught and fixes to address Issue #2597
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2022-08-13 04:51:54 -05:00 |
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e66a4b2423
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Changed a few; now pulling new ones from commit c2115c2 so I do not replicate
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2022-08-13 01:32:49 -05:00 |
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78c10bac4a
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clang-format update
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2022-04-23 13:08:11 -04:00 |
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115962db88
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Merge branch 'develop' into remove-error-docs-in-header
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2022-04-23 12:46:54 -04:00 |
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79a7d2abf6
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remove error docs from header files
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2022-04-22 23:31:15 -04:00 |
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69d9c5187e
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refactor group access, enable and apply clang-format
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2022-04-15 15:29:43 -04:00 |
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200b4f13c7
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use dynamic cast instead of c-style cast when casting from base type to derived class
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2022-04-10 18:18:06 -04:00 |
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369b8365bf
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update QEQ, ASPHERE, and KIM packages to use new neighbor list request API
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2022-03-08 05:16:55 -05:00 |
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d6a6f64576
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Merge pull request #3090 from rbberger/modernize_use_override
Modernize to C++11: use override
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2022-01-28 14:10:45 -05:00 |
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f9a2006d73
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reorder includes
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2022-01-24 08:44:29 -05:00 |
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06beb28d7d
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Apply override to Pair classes
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2022-01-21 16:13:49 -05:00 |
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ff3f762499
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Apply override to Fix classes
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2022-01-21 14:45:53 -05:00 |
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f83271aa40
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Apply override to Compute classes
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2022-01-21 13:23:36 -05:00 |
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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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6ccdeafa78
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reformat with clang-format
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2021-08-17 10:22:42 -04:00 |
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42fadf55cf
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fix typos
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2021-08-17 10:05:58 -04:00 |
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f08c249d40
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don't hide parameter with local variable
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2021-08-13 06:23:46 -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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7fcd449864
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apply clang-format to all headers with some exceptions
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2021-05-14 19:16:07 -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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a1665fddc8
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next iteration of preparing for clang-format
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2021-04-30 13:51:14 -04:00 |
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980244dd0c
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add protection comments
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2021-04-27 22:31:01 -04:00 |
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df7fe4431f
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make LAMMPS homepage URL and C++ indicator comments consistent
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2021-04-22 21:26:07 -04:00 |
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b32570c15e
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simplify by using utils::strdup() and reorder includes
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2021-03-28 22:22:13 -04:00 |
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27e31c4b15
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simplify
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2021-03-25 14:49:49 -04:00 |
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