diff --git a/src/AMOEBA/amoeba_induce.cpp b/src/AMOEBA/amoeba_induce.cpp index 3723050326..3d9d7809cc 100644 --- a/src/AMOEBA/amoeba_induce.cpp +++ b/src/AMOEBA/amoeba_induce.cpp @@ -388,7 +388,7 @@ void PairAmoeba::induce() // NOTE: could make this an error if (iter >= maxiter || eps > epsold) - if (comm->me == 0) + if (comm->me == 0) error->warning(FLERR,"AMOEBA induced dipoles did not converge"); }