Unverified Commit 0008c0ec authored by Axel Kohlmeyer's avatar Axel Kohlmeyer
Browse files

need to setup bins again if binning style has be reset

parent 262ce37e

src/nbin.cpp

+3 −1
Original line number Diff line number Diff line
@@ -26,11 +26,13 @@ using namespace LAMMPS_NS; 
NBin::NBin(LAMMPS *lmp) : Pointers(lmp)

{

  last_bin = -1;

  maxbin = maxatom = 0;

  mbins = maxbin = maxatom = 0;

  binhead = NULL;

  bins = NULL;

  atom2bin = NULL;



  neighbor->last_setup_bins = -1;



  // geometry settings



  dimension = domain->dimension;

src/neighbor.cpp

+1 −0
Original line number Diff line number Diff line
@@ -2078,6 +2078,7 @@ void Neighbor::build(int topoflag) 
  //   leading to errors or even a crash



  if (style != Neighbor::NSQ) {

    if (last_setup_bins < 0) setup_bins();

    for (int i = 0; i < nbin; i++) {

      neigh_bin[i]->bin_atoms_setup(nall);

      neigh_bin[i]->bin_atoms();

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