From 1e40c52c97c854d948c6b6de58877bb4ce2ea915 Mon Sep 17 00:00:00 2001 From: sjplimp Date: Wed, 30 Apr 2014 15:17:50 +0000 Subject: [PATCH] git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11849 f3b2605a-c512-4ea7-a41b-209d697bcdaa --- src/MC/fix_gcmc.cpp | 11 +++++++++++ 1 file changed, 11 insertions(+) diff --git a/src/MC/fix_gcmc.cpp b/src/MC/fix_gcmc.cpp index 9bb5c1f2e8..03953ed10e 100644 --- a/src/MC/fix_gcmc.cpp +++ b/src/MC/fix_gcmc.cpp @@ -237,6 +237,17 @@ FixGCMC::~FixGCMC() if (regionflag) delete [] idregion; delete random_equal; delete random_unequal; + + // remove rotation group this fix defined + + if (rotation_group) { + char **group_arg = new char*[2]; + group_arg[0] = group->names[rotation_group]; + group_arg[1] = (char *) "delete"; + group->assign(2,group_arg); + delete [] group_arg; + } + memory->destroy(local_gas_list); memory->destroy(atom_coord); memory->destroy(model_atom_buf);