How to pass command line arguments

[samwaseda]

This one is closely related to this issue. Now I'd like to pass command line arguments to the executable. Currently, the LAMMPS executable contains:

#!/bin/bash
module load pyiron/dev
mpiexec -n $1 lmp_mpi -in control.inp

But I'd like to extend it to something like

#!/bin/bash
module load pyiron/dev
mpiexec -n $1 lmp_mpi -in control.inp ${@:2}

and from LammpsBase I'd love to pass custom arguments. Is there a possibility to do something like this?

[jan-janssen]

@samwaseda Currently it is not possible.

[samwaseda]

@niklassiemer Was I supposed to do this one in the end or are you gonna do it? I can't remember what we agreed on at the pyiron meeting...

[niklassiemer]

I will take a shot at this, however, starting with next week.