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5c4bf8ac47
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bond/react: optional EdgeIDs take2
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2018-06-26 20:40:02 -06:00 |
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ebe622ff7d
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make edge atoms optional
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2018-06-26 09:35:38 -06:00 |
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3750e0a427
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resolve newton setting and parallel disparities, improve syntax error catching
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2018-06-16 11:13:52 -06:00 |
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8303d1a375
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allow smooth restarts
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2018-05-13 22:49:54 -06:00 |
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f864584bce
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correct small bugs found by coverity scan static code analysis
- in fix rigid, rigid/small, and poems, a string argument was
incorrectly assigned to a %d format
- plug two small memory leaks in fix bond/react
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2018-05-11 00:43:09 -04:00 |
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863a85353a
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type reassignment bugfix for edge atoms
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2018-05-09 23:55:04 -06:00 |
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941d289a69
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cosmetic changes to avoid compiler warnings
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2018-05-06 10:54:34 -04:00 |
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e1f9ee1347
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fix1
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2018-05-06 01:04:23 -06:00 |
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916ed71760
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fix bond/react final touches
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2018-05-06 00:34:03 -06:00 |
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c8a0689d78
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correct typo in converting c-library header includes to c++ styles
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2018-05-03 15:44:17 -04:00 |
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28786ef99b
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tweak to header file names
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2018-05-03 11:49:27 -06:00 |
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caa990746e
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bugfix
fixes crash e.g. when building on Ubuntu for Windows
thanks to Márk Jenei (University of Cambridge) for submitting error report
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2018-04-18 22:27:12 -06:00 |
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e8eeb52636
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fix memory leaks detected by valgrind
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2018-03-03 19:31:53 -05:00 |
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21364f38b0
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gatherv fix, take 2
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2018-03-01 23:11:46 -07:00 |
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51b19dfd1a
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plug memory leak in fix bond/react
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2018-02-25 14:10:28 +01:00 |
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7d1de34533
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gatherv fix, doc updates
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2018-02-24 22:49:28 -07:00 |
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d5e43a9ab1
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whitespace cleanup and reindent
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2018-02-23 10:20:29 +01:00 |
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8fef7880e7
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dead code removal and loop construct fixes to silence compiler warnings.
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2018-02-22 02:23:57 -05:00 |
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a8eb3ff77f
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consolidate per-atom property fixes into one
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2018-02-21 23:20:17 -07:00 |
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5191071581
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no need to cast fixes to specific styles/types
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2018-02-21 11:15:44 +01:00 |
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b6821ed942
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since the code uses static ids, only one instance is allowed at a time
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2018-02-21 11:15:09 +01:00 |
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deeba53a24
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consolidate inclusion file style with LAMMPS conventions
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2018-02-21 11:14:32 +01:00 |
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75a432833b
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remove messy hack
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2018-02-18 17:11:06 +01:00 |
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5843be1557
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move fix bond/react to USER-MISC package
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2018-02-18 17:03:40 +01:00 |
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