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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8312 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2012-06-18 23:49:36 +00:00
parent 5208299da4
commit bb48c5ccdc
5 changed files with 24 additions and 16 deletions
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4
src/min.cpp
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@ -234,6 +234,7 @@ void Min::setup()
if (atom->sortfreq > 0) atom->sort();
comm->borders();
if (triclinic) domain->lamda2x(atom->nlocal+atom->nghost);
domain->box_too_small_check();
neighbor->build();
neighbor->ncalls = 0;
@ -319,6 +320,7 @@ void Min::setup_minimal(int flag)
comm->exchange();
comm->borders();
if (triclinic) domain->lamda2x(atom->nlocal+atom->nghost);
domain->box_too_small_check();
neighbor->build();
neighbor->ncalls = 0;
}
@ -432,6 +434,8 @@ void Min::cleanup()
// delete fix at end of run, so its atom arrays won't persist
modify->delete_fix("MINIMIZE");
domain->box_too_small_check();
}
/* ----------------------------------------------------------------------