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Latest developments and applications of the OPTIMADE API for materials data exchange and discoverability

This repo contains some scripts and results associated with the paper "Latest developments and applications of the OPTIMADE API for materials data exchange and discoverability" by Andersen et al. (2023).

Examples
Querying for high entropy alloys across all databases and training a ML model ./src/high_entropy_alloys_ml

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  • Jupyter Notebook 93.7%
  • Python 6.3%