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mention restriction for use with fix shake or fix rigid in fix gcmc docs

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Axel Kohlmeyer 2017-07-10 17:34:00 -04:00
parent b5e9e90bb6
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doc/src/fix_gcmc.txt
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@ -383,6 +383,9 @@ called. Reneighboring is required.
Can be run in parallel, but aspects of the GCMC part will not scale
well in parallel. Only usable for 3D simulations.
When using fix gcmc in combination with fix shake or fix rigid,
only gcmc exchange moves are supported.
Note that very lengthy simulations involving insertions/deletions of
billions of gas molecules may run out of atom or molecule IDs and
trigger an error, so it is better to run multiple shorter-duration