Merge branch 'develop' into collected-small-fixes

This commit is contained in:
Axel Kohlmeyer
2023-11-01 05:01:03 -04:00
2 changed files with 10 additions and 0 deletions

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@ -100,6 +100,11 @@ void ComputeClusterAtom::compute_peratom()
vector_atom = clusterID;
}
// communicate coords for ghost atoms if box can change, e.g. fix deform
// this ensures ghost atom coords are current
comm->forward_comm();
// invoke full neighbor list (will copy or build if necessary)
// on the first step of a run, set preflag to one in neighbor->build_one(...)