Molpro/Batch

You can submit a Molpro job (test.inp) in batch mode with the following command:

sbatch [Slurm options] --wrap="molpro [Molpro options] -o test.out test.inp"

Here you need to replace [Molpro options] with Molpro command line options (you can display the options with the command molpro -h) and [Slurm options] with Slurm parameters for the resource requirements of the job. Please find a documentation about the parameters of sbatch on the wiki page about the batch system.