diff --git a/src/USER-REAXC/fix_reaxc_species.cpp b/src/USER-REAXC/fix_reaxc_species.cpp index b370814933..958ef05803 100644 --- a/src/USER-REAXC/fix_reaxc_species.cpp +++ b/src/USER-REAXC/fix_reaxc_species.cpp @@ -318,7 +318,7 @@ void FixReaxCSpecies::create_compute() args = new char*[narg]; args[0] = (char *) "SPECATOM"; args[1] = (char *) "all"; - args[2] = (char *) "spec/atom"; + args[2] = (char *) "SPEC/ATOM"; args[3] = (char *) "q"; args[4] = (char *) "x"; args[5] = (char *) "y";