aiida-core
https://github.com/aiidateam/aiida-core
Python
The official repository for the AiiDA code
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- Issues
- WorkChains need to be restart-able
- Move user-specific computer methods from computer to DbAuthInfo
- BandsData: suggestion for improvements
- REST API has unhandled errors
- Define KpointsData via constructor
- General/Common local time parser
- Filtering for `None` in QueryBuilder
- when pausing a workchain, also pause its children?
- functionality for describing all the nodes
- Schedulers: add reservation and partition fields?
- Docs
- Python not yet supported