From 37d905578cf752b1630f9f5e3e78c96d338782c2 Mon Sep 17 00:00:00 2001
From: pscrozi <pscrozi@f3b2605a-c512-4ea7-a41b-209d697bcdaa>
Date: Tue, 31 Jul 2012 17:55:48 +0000
Subject: [PATCH] Adding a domain remap after doing an MC particle move. This
 fixes a bug that shows up when an MC particle move moves a particle through
 the PBC.

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8515 f3b2605a-c512-4ea7-a41b-209d697bcdaa
---
 src/MC/fix_gcmc.cpp | 2 ++
 1 file changed, 2 insertions(+)

diff --git a/src/MC/fix_gcmc.cpp b/src/MC/fix_gcmc.cpp
index dd314d772d..40b6ee7741 100644
--- a/src/MC/fix_gcmc.cpp
+++ b/src/MC/fix_gcmc.cpp
@@ -270,6 +270,7 @@ void FixGCMC::attempt_move()
   double rx,ry,rz;
   double coord[3];
   double **x = atom->x;
+  tagint *image = atom->image;
 
   nmove_attempts += 1.0;
 
@@ -296,6 +297,7 @@ void FixGCMC::attempt_move()
       x[i][0] = coord[0];
       x[i][1] = coord[1];
       x[i][2] = coord[2];
+      domain->remap(x[i],image[i]);
       success = 1;
     }
   }