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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5797 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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This commit is contained in:
sjplimp
2011-03-18 15:09:03 +00:00
parent b4fc6e0421
commit 159d131e37
21 changed files with 493 additions and 167 deletions
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9
src/atom.cpp
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@ -55,6 +55,7 @@ Atom::Atom(LAMMPS *lmp) : Pointers(lmp)
firstgroupname = NULL;
sortfreq = 1000;
nextsort = 0;
userbinsize = 0.0;
maxbin = maxnext = 0;
binhead = NULL;
@ -1357,6 +1358,10 @@ void Atom::sort()
{
int i,m,n,ix,iy,iz,ibin,empty;
// set next timestep for sorting to take place
nextsort = (update->ntimestep/sortfreq)*sortfreq + sortfreq;
// re-setup sort bins if needed
if (domain->box_change) setup_sort_bins();
@ -1440,10 +1445,6 @@ void Atom::sort()
//int flagall;
//MPI_Allreduce(&flag,&flagall,1,MPI_INT,MPI_SUM,world);
//if (flagall) error->all("Atom sort did not operate correctly");
// set next timestep for sorting to take place
nextsort = (update->ntimestep/sortfreq)*sortfreq + sortfreq;
}
/* ----------------------------------------------------------------------