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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8696 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2012-08-21 14:13:53 +00:00
parent 55ad68cbe3
commit 25a2d17537
1 changed files with 6 additions and 2 deletions
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8
src/domain.cpp
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@ -1,4 +1,4 @@
/* ----------------------------------------------------------------------
</* ----------------------------------------------------------------------
LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
http://lammps.sandia.gov, Sandia National Laboratories
Steve Plimpton, sjplimp@sandia.gov
@ -531,10 +531,14 @@ void Domain::box_too_small_check()
{
int i,j,k;
// only need to check if system is molecluar and some dimension is periodic
// only need to check if system is molecular and some dimension is periodic
// if running verlet/split, don't check on KSpace partition since
// it has no ghost atoms and thus bond partners won't exist
if (!atom->molecular) return;
if (!xperiodic && !yperiodic && (dimension == 2 || !zperiodic)) return;
if (strcmp(update->integrate_style,"verlet/split") == 0 &&
universe->iworld != 0) return;
// maxbondall = longest current bond length
// NOTE: if box is tiny (less than 2 * bond-length),