Jan Janssen

As Liam said the GenericJob is also the foundation for the GenericMaster and consequently the ParallelMaster and InteractiveWrapper - some of these do not even have input and output.

@Leimeroth Can you help here? I thought we had this fixed that `transfer_from_remote()` is never called directly by the user.

Debug the remote submission: ```python from pysqa.queueadapter import QueueAdapter qa = QueueAdapter(directory="~/.queues") qa._adapter._execute_remote_command("python --version”) >>> Python 3.11.8 ``` Additional commands for debugging: ```python qa._adapter._execute_remote_command(“squeue”) ``` If the command is not...

Not only for the remote setup but also for the default setup the use of if statements in the jinja template files is not so intuitive for new users. This...

Add support for resource definition during submission time and function dependence in analogy to pympipool: - https://pympipool.readthedocs.io/en/latest/examples.html#resource-assignment - https://pympipool.readthedocs.io/en/latest/examples.html#coupled-functions

Especially in combination with the remote submission using SSH it is important to synchronise the local and the remote cache. To make this cache visible to the user it would...

Example calculation for demonstration would be the calculation of a band structure with VASP. This requires two calculation with the WAVECAR being copied from the first to the second calculation....

An example based on `executorlib` and `pysqa` is available in https://github.com/pyiron-dev/remote-executor

The command is practically already available https://github.com/pyiron/pysqa/blob/main/pysqa/wrapper/slurm.py#L70 but we are missing a framework to use it with.

> I will test if they are faster. If they are I would add them as defaults and as values in queue.yaml I set this pull request to `draft` until...