#!/bin/bash
#SBATCH --partition=batch
#SBATCH --job-name=turbomole-7.8-case
#SBATCH --nodes=2
#SBATCH --ntasks-per-node=20
#SBATCH --time=30:00

export PARA_ARCH=MPI
export PARNODES=${SLURM_NTASKS}

module load turbomole/7.8

export MPI_USESRUN=1

ulimit -s unlimited

jobex -ri > jobex.out