From 3b866eedc06bbb71ac359625b55812a12222aaa3 Mon Sep 17 00:00:00 2001 From: sjplimp Date: Mon, 17 Jun 2013 16:11:37 +0000 Subject: [PATCH] git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10082 f3b2605a-c512-4ea7-a41b-209d697bcdaa --- src/fix_efield.cpp | 6 ++++++ 1 file changed, 6 insertions(+) diff --git a/src/fix_efield.cpp b/src/fix_efield.cpp index a3aae2423a..a2962fb5f9 100644 --- a/src/fix_efield.cpp +++ b/src/fix_efield.cpp @@ -23,6 +23,7 @@ #include "atom.h" #include "update.h" #include "domain.h" +#include "comm.h" #include "modify.h" #include "force.h" #include "respa.h" @@ -180,6 +181,11 @@ void FixEfield::init() if (muflag && varflag == ATOM) error->all(FLERR,"Fix efield with dipoles cannot use atom-style variables"); + if (muflag && update->whichflag == 2 && comm->me == 0) + error->warning(FLERR, + "The minimizer does not re-orient dipoles " + "when using fix efield"); + if (varflag == CONSTANT && estyle != NONE) error->all(FLERR,"Cannot use variable energy with " "constant efield in fix efield");