Commit 48ada5bf by Francois Gygi

fix reset_vcm in randomize_velocities

git-svn-id: http://qboxcode.org/svn/qb/trunk@1756 cba15fb0-1239-40c8-b417-11db7ca47a34
parent b9d75cbd
......@@ -496,8 +496,8 @@ void AtomSet::randomize_velocities(double temp)
v[is][3*ia+2] = width * xi2;
}
}
reset_vcm();
set_velocities(v);
reset_vcm();
}
////////////////////////////////////////////////////////////////////////////////
......
Markdown is supported
0% or
You are about to add 0 people to the discussion. Proceed with caution.
Finish editing this message first!
Please register or to comment