git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15364 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp 2016-07-23 00:24:54 +00:00
parent caf9483a0a
commit 08ac3d54dd
3 changed files with 14 additions and 3 deletions

View File

@ -1931,6 +1931,17 @@ void Neighbor::set(int narg, char **arg)
if (style == MULTI && lmp->citeme) lmp->citeme->add(cite_neigh_multi);
}
/* ----------------------------------------------------------------------
reset timestamps in all NeighList classes
so that neighbor lists will rebuild properly with timestep change
------------------------------------------------------------------------- */
void Neighbor::reset_timestep(bigint ntimestep)
{
for (int i = 0; i < nlist; i++)
lists[i]->last_build = -1;
}
/* ----------------------------------------------------------------------
modify parameters of the pair-wise neighbor build
------------------------------------------------------------------------- */

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@ -86,6 +86,7 @@ class Neighbor : protected Pointers {
void build_one(class NeighList *list,
int preflag=0); // create a single one-time neigh list
void set(int, char **); // set neighbor style and skin distance
void reset_timestep(bigint); // reset of timestep counter
void modify_params(int, char**); // modify parameters that control builds
bigint memory_usage();
int exclude_setting();

View File

@ -448,10 +448,9 @@ void Update::reset_timestep(bigint newstep)
for (int i = 0; i < modify->ncompute; i++)
if (modify->compute[i]->timeflag) modify->compute[i]->clearstep();
// set last_build of all neigh lists to -1 to force rebuild
// Neighbor Bin/Stencil/Pair classes store timestamps that need to be cleared
for (int i = 0; i < neighbor->nlist; i++)
neighbor->lists[i]->last_build = -1;
neighbor->reset_timestep(ntimestep);
// NOTE: 7Jun12, adding rerun command, don't think this is required