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4fa95de91c
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update logfiles for gcmc example inputs
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2018-04-04 12:33:48 -04:00 |
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24e0ca5377
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avoid warning about group all
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2018-04-04 12:28:20 -04:00 |
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d1356c1d76
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Made ndof dynamic for temperature fixes and computes
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2018-04-03 15:07:04 -06:00 |
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1d403b2aa3
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Added warning to discourage use of group all and fixed some segfault cases
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2018-02-05 13:29:14 -07:00 |
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e4b14213b4
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delete old log files. new log files are approved by @athomps
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2017-11-28 11:35:49 -05:00 |
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adbc75cae6
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add alternate log files with the latest version of LAMMPS
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2017-11-13 11:52:01 -05:00 |
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dde94c28a7
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new example scripts for fix gcmc
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2017-11-13 09:07:25 -07:00 |
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92395e9bb4
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disallow MC moves with fix rigid and fix shake active. update examples and add shake example
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2017-07-10 17:19:37 -04:00 |
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111d350a22
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fix gcmc units change for chemical potential
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2017-03-28 12:34:46 -06:00 |
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394e9b42b0
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new CHARMM pair styles with force swithing/shifting
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2017-03-24 13:53:07 -06:00 |
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