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4a2d3e95cb
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Replace Atom::count_words with utils::count_words
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2020-05-20 15:53:19 -04:00 |
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0a96a8c3a5
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make check for running under hybrid/overlay compatible with suffix styles
also improve error message
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2020-04-24 21:23:21 -04:00 |
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649a8cc01a
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Fix typo
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2020-03-14 13:57:48 +09:00 |
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956d21ec0e
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update include lists in packages USER-MISC, USER-MOFF, USER-PTM, and USER-SMD
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2019-07-10 15:51:57 -04:00 |
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da6e576ffd
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silence warnings about unused variables and parameters, minor tweaks
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2019-05-05 10:17:45 -04:00 |
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db54b03751
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Force line length to 80
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2019-05-04 22:55:22 -05:00 |
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24e41bc085
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Update doc and examples due to the change of parameters
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2019-05-04 22:24:05 -05:00 |
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4c19eab64c
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Bugfix no 3 nearest neighbors for ghost atoms near boundary
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2019-04-23 14:39:47 -05:00 |
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e700ccd4df
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Update header
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2019-04-17 22:11:24 -05:00 |
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4621af4b9d
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Modify to accept NULL for pair_coeff
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2019-04-17 21:34:55 -05:00 |
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f27ed871f9
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Uncrustify code
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2019-04-17 18:11:31 -05:00 |
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16bb8a1439
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Clean up comments
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2019-04-17 16:58:18 -05:00 |
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d6f3a95599
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Remove unused variables and methods
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2019-04-17 10:53:45 -05:00 |
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cb30414820
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Add contribution to virial and atom virial
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2019-04-17 10:05:05 -05:00 |
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82a87322ed
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Get the same forces as KIM implementation
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2019-04-16 16:54:17 -05:00 |
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5fb164d586
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Get total energy correct
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2019-04-16 15:04:16 -05:00 |
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835fce7a5e
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Copy all function from KIM implementation to PairDRIP
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2019-04-16 10:51:20 -05:00 |
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fdaa3f48e9
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Modify all methods other than compute
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2019-04-15 22:38:51 -05:00 |
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2bdd9b7544
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Remove single
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2019-04-15 20:14:10 -05:00 |
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100f17077c
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Create pair_drip by copying KC files
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2019-04-15 19:27:41 -05:00 |
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