diff --git a/make_cp2k.sh b/make_cp2k.sh index 830728c412..e489dcfa15 100755 --- a/make_cp2k.sh +++ b/make_cp2k.sh @@ -1227,9 +1227,11 @@ ln -sf cp2k."${VERSION}" cp2k."${VERSION/smp/opt}" ln -sf cp2k."${VERSION}" cp2k_shell cd "${CP2K_ROOT}" || ${EXIT_CMD} 1 -# Allow to run as root within a container with OpenMPI +# Allow to run as root with OpenMPI if [[ "${MPI_MODE}" == "openmpi" ]]; then OMPI_VARS="export OMPI_ALLOW_RUN_AS_ROOT=1 OMPI_ALLOW_RUN_AS_ROOT_CONFIRM=1 OMPI_MCA_plm_rsh_agent=/bin/false" +else + OMPI_VARS="" fi export OMPI_VARS