diff --git a/src/KOKKOS/kokkos.cpp b/src/KOKKOS/kokkos.cpp index 7b27ba3523..180e3d8499 100644 --- a/src/KOKKOS/kokkos.cpp +++ b/src/KOKKOS/kokkos.cpp @@ -160,13 +160,14 @@ void KokkosLMP::accelerator(int narg, char **arg) if (strcmp(arg[iarg],"neigh") == 0) { if (iarg+2 > narg) error->all(FLERR,"Illegal package kokkos command"); if (strcmp(arg[iarg+1],"full") == 0) neighflag = FULL; - else if (strcmp(arg[iarg+1],"half/thread") == 0) neighflag = HALFTHREAD; - else if (strcmp(arg[iarg+1],"half") == 0) neighflag = HALF; - else if (strcmp(arg[iarg+1],"n2") == 0) neighflag = N2; + else if (strcmp(arg[iarg+1],"half") == 0) { + if (num_threads > 1 || ngpu > 0) + neighflag = HALFTHREAD; + else + neighflag = HALF; + } else if (strcmp(arg[iarg+1],"n2") == 0) neighflag = N2; else if (strcmp(arg[iarg+1],"full/cluster") == 0) neighflag = FULLCLUSTER; else error->all(FLERR,"Illegal package kokkos command"); - if (neighflag == HALF && (num_threads > 1 || ngpu > 0)) - error->all(FLERR,"Must use Kokkos half/thread or full neighbor list with threads or GPUs"); iarg += 2; } else if (strcmp(arg[iarg],"binsize") == 0) { if (iarg+2 > narg) error->all(FLERR,"Illegal package kokkos command");