during setup, checking timestep doesn't seem to be sufficient. comparing bins... (4a09399d) · Commits · 郑智淋 / lammps

src/npair.cpp

+4 −3

Original line number	Diff line number	Diff line
		@@ -24,7 +24,8 @@ using namespace LAMMPS_NS;

		/* ---------------------------------------------------------------------- */

		NPair::NPair(LAMMPS *lmp) : Pointers(lmp)
		NPair::NPair(LAMMPS *lmp)
		: Pointers(lmp), nb(NULL), ns(NULL), bins(NULL), stencil(NULL)
		{
		last_build = -1;
		last_copy_bin_setup = last_copy_bin = last_copy_stencil = -1;
		@@ -130,11 +131,11 @@ void NPair::build_setup()
		copy_bin_setup_info();
		last_copy_bin_setup = update->ntimestep;
		}
		if (nb && last_copy_bin < nb->last_bin_memory) {
		if (nb && ((last_copy_bin < nb->last_bin_memory) \|\| (bins != nb->bins))) {
		copy_bin_info();
		last_copy_bin = update->ntimestep;
		}
		if (ns && last_copy_stencil < ns->last_create) {
		if (ns && ((last_copy_stencil < ns->last_create) \|\| (stencil != ns->stencil))) {
		copy_stencil_info();
		last_copy_stencil = update->ntimestep;
		}