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1bba2c9e06
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third and final round of include-what-you-use updates
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2024-02-28 17:40:17 -05:00 |
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1359c52f30
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include-what-you-use updates
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2024-02-27 23:42:24 -05:00 |
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6ccf5f107c
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fix a bug in fix pair
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2023-06-18 20:39:18 -05:00 |
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27da716852
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getting out of the insurance business :-)
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2023-01-23 16:45:41 -05:00 |
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20b6355888
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refactor fix_pair.h/cpp: extract method "query_pstyle" and call it also in void FixPair::init()
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2023-01-04 15:00:03 +01:00 |
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bcb5285ef9
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update / correct suffix handling in fix pair
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2023-01-03 14:15:12 -05:00 |
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295d8a6903
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fix_pair.cpp: respect lmp->suffix when looking for pair_style name match
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2023-01-03 15:58:34 +01:00 |
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a3c0be875e
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include-what-you-use updates
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2022-12-11 22:46:54 -05:00 |
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a714a60ed3
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we need to use Error::one() since not all MPI ranks might trigger
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2022-10-26 16:14:48 -04:00 |
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e4ca652648
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BUGFIX: raise error only if some atoms in current spatial domain but extracted per-atom array is still nullptr
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2022-10-26 18:50:08 +02:00 |
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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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422042bf66
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Merge pull request #3455 from lammps/fix-pair-min-tweak
Adjust fix pair to work better with minimization
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2022-09-22 12:25:04 -04:00 |
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6c9c61e763
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remove debug output
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2022-09-22 10:45:53 -04:00 |
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39763444c5
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add lasttime check to fix pair
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2022-09-21 14:03:04 -06:00 |
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7c2013d862
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silence compiler warnings
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2022-09-21 10:01:53 -04:00 |
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3770c02752
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fix typo
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2022-09-15 09:22:20 -04:00 |
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a52c4a5537
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improve error messages
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2022-09-14 14:35:57 -04:00 |
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7f4fe0d3ad
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whitespace
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2022-09-09 17:29:11 -04:00 |
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f9c49620b3
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add minimization support
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2022-09-02 09:38:24 -06:00 |
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4d062f70ce
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bug fix for per-atom vector output of fix pair
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2022-08-31 10:09:59 -06:00 |
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ec4c458c7e
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add Pair::extract_atom() method
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2022-07-29 10:54:42 -06:00 |
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4de0944f8b
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streamlined string ops
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2022-07-28 15:24:58 -06:00 |
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348feddcb6
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new fix pair and dump_modify skip commands
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2022-07-28 12:45:20 -06:00 |
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f039c00442
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add dump skip option
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2022-07-27 17:13:46 -06:00 |
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