aiida-core
https://github.com/aiidateam/aiida-core
Python
The official repository for the AiiDA code
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- Issues
- Computer, Code, Calculation handling: suggestions for improvements.
- Remove repeated docstring from inherited methods
- Docs: introduction to node extras and node attributes.
- orm.Computer define class constants for all properties
- Should `Data.__deepcopy__` return a clone of the node
- Remove unnecessary methods from `Data` class
- Caching: ph process failed if previous pw.x process finished_ok and cached but remote folder cleaned.
- quote/unquote parsing in rest api filters
- Process functions have inconsistent behavior in validating inputs nested in dictionaries
- Check that values put in the workchain context can be deserialized
- Docs
- Python not yet supported