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After applying the centralized CI to pyiron_contrib, the dependabot PRs revealed that the current automated update to docs and binder environment files breaks for third-party PRs, e.g.:
```
Run ac…
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We should think about adding a benchmark which times typical `job[item]` queries and make sure we do not merge changes in the future which slow down.
_Originally posted by @jan-janssen in https://g…
pmrv updated
6 months ago
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**Summary**
Hi all,
I find all my lammps jobs are crashed for unknown reasons. These jobs are submitted via pyiron. I have tested them in a command line, and there is no issue. I also submitted a …
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In other repos where the CI is already migrated (e.g. [ironflow](https://github.com/pyiron/ironflow/tree/main/.github/workflows), [pyiron_module_template](https://github.com/pyiron/pyiron_module_templ…
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**Summary**
I conduct some DFT calculations via VASP on pyiron environment.
I didn't use remote submit, I just accessed our HPC cluster and conducted DFT calculations.
But pyiron cannot catch job…
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**Summary**
The functionality of @liamhuber workflow class in pyiron_contrib could be a good starting point for interesting extensions and merging pyiron_base and ironflow.
@liamhuber, I had on…
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The current startup process for running nginx with support for sso (keycloak), and pyiron, in fact
in general any auxiliary application container that nginx plays proxy for, requires first starting n…
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I find it nice that it's a functional complete QE example, but I find it too long for something that appears as a single example on the homepage. Either we make it shorter or we make a short example f…
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using the ase.io.read and then ase_to_pyiron did not work (get_chemical_species error), do we have another function to do so directly?
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1. Issue with the database class
```
/home/runner/work/pyiron_base/pyiron_base/pyiron_base/database/generic.py:758: SADeprecationWarning: The LegacyRow.values() method is deprecated and will be rem…