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The python-side aiida-dftk and the julia-side AiidaDFTK.jl will inevitably have some form of version locking, in the sense that their expected IO interfaces depend on each other. We should agree on so…
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## Automated report
_This issue was created with the app's automated bug reporting feature.
Attached to this issue is the full traceback as well as an environment
fingerprint that contains inform…
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Hi @chrisjsewell,
We are now posting AiiDA blog posts directly to the AiiDA website (see https://aiida.net/news/index/category/blog.html).
And just to reduce duplication, we though that it might…
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For instance, `aiida_localhost` in `manage/tests/pytest_fixtures.py`:
https://github.com/aiidateam/aiida-core/blob/dd866ce816e986285f2c5794f431b6e3c68a369b/src/aiida/manage/tests/pytest_fixtures.py…
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Please check these boxes before submitting your issue, thank you!
- [x] aiida-vasp and aiida-core are installed in a virtualenv that is used for nothing else
- [x] if you are installing from the…
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First version, users provide a small script to clean directory after processing. Possibly use AiiDA's `cleanworkdir` functionality instead (be careful with provenance).
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There are quite some use also in documentation suggest
```python
import aiida
aiida.load_profile()
```
My LSP complain that the `load_profile` is not exported from module "aiida". The reaso…
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I just tried running the `eos` `WorkGraph` from `workgraph_collections` and ended up passing a `StructureData` where an `Atoms` object should have been passed. The traceback I got (see below) was a bi…
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- [x] [AiiDA Troubleshooting Documentation](https://aiida.readthedocs.io/projects/aiida-core/en/stable/installation/troubleshooting.html)
- [x] [AiiDA Discourse Forum](https://aiida.discourse.gro…