Jan Janssen

@Leimeroth I made some progress in this direction with https://github.com/pyiron/pyiron_base/pull/878 and https://github.com/pyiron/pysqa/pull/143 Can you check if this solves this issue?

To my knowledge the Murnaghan example already fails when running without database, unless the individual jobs are executed in interactive mode.

Just for me to understand the current configuration, locally you use an SQL database and on the remote cluster you use pyiron without a database, correct?

@ligerzero-ai Can you take a look at this? As `pysqa` can return the working directory https://github.com/pyiron/pysqa/pull/143 it should be able to fix this bug by matching jobs in pyiron based...

@ligerzero-ai and I recently worked on this, can you check if https://github.com/pyiron/pyiron_base/pull/1067 helps to fix your bug.

Maybe we could add a flag to the lammps interactive mode which automatically applies this transformation, as I have the feeling this issue comes up from time to time again.

Just like we discussed about the changes of not writing to the file system, I think also these changes should be made in `pyiron_contrib` first in particular when changing the...

> So the argument "because the changes of not writing to the file system had to be done elsewhere, this one should be done also elsewhere" doesn't apply. To be...

> 2. Refactor code wherever it's necessary to make sure that `to_hdf` does only storing (and `from_hdf` only loading), which was something @liamhuber and I also discussed [here](https://github.com/pyiron/pyiron_base/pull/903) > 3....

> But today we are offering pyiron as a workflow platform, so now it matters a lot that we have concepts on the code level. I completely agree. But I...