From 25992ae9f7c4f9d24d4fe97a08791e5fe75d6060 Mon Sep 17 00:00:00 2001 From: athomps <athomps@f3b2605a-c512-4ea7-a41b-209d697bcdaa> Date: Mon, 4 Apr 2016 21:01:02 +0000 Subject: [PATCH] fixed bug in triclinic case git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14800 f3b2605a-c512-4ea7-a41b-209d697bcdaa --- src/VORONOI/compute_voronoi_atom.cpp | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/src/VORONOI/compute_voronoi_atom.cpp b/src/VORONOI/compute_voronoi_atom.cpp index b349cbd671..d367e91a96 100644 --- a/src/VORONOI/compute_voronoi_atom.cpp +++ b/src/VORONOI/compute_voronoi_atom.cpp @@ -260,8 +260,8 @@ void ComputeVoronoi::buildCells() // cutghost is in lamda coordinates for triclinic boxes, use subxx_lamda double *h = domain->h; for( i=0; i<3; ++i ) { - sublo_bound[i] = sublo[i]-cut[i]-e; - subhi_bound[i] = subhi[i]+cut[i]+e; + sublo_bound[i] = sublo_lamda[i]-cut[i]-e; + subhi_bound[i] = subhi_lamda[i]+cut[i]+e; if (domain->periodicity[i]==0) { sublo_bound[i] = MAX(sublo_bound[i],0.0); subhi_bound[i] = MIN(subhi_bound[i],1.0); -- GitLab