cannot currently use replicate command with atom style template

2020-10-28 15:42:50 -04:00
parent c25ef8edb0
commit 9f1526c66d
1 changed files with 3 additions and 0 deletions
--- a/src/replicate.cpp
+++ b/src/replicate.cpp
@ -43,6 +43,9 @@ void Replicate::command(int narg, char **arg)
    error->all(FLERR,"Replicate command before simulation box is defined");
  if (narg < 3 || narg > 4) error->all(FLERR,"Illegal replicate command");

+  if (atom->molecular == Atom::TEMPLATE)
+    error->all(FLERR,"Cannot use replicate command with atom style template");
+
  int me = comm->me;
  int nprocs = comm->nprocs;