OPTIMADE

The Open Databases Integration for Materials Design (OPTIMADE) consortium offers a common application programming interface (API) to make materials databases accessible and interoperable. JARVIS-OPTIMADE is designed to provide JARVIS data in REST-API format following OPTIMADE protocols. Currently, we host JARVIS-DFT in this page, more datasets to follow.


Examples:
1. https://jarvis.nist.gov/optimade/jarvisdft/v1/structures/?filter=elements HAS ANY C,Si,Ge
2. https://jarvis.nist.gov/optimade/jarvisdft/v1/structures/?filter=elements HAS ALL C,Si,Ge
3. https://jarvis.nist.gov/optimade/jarvisdft/v1/structures/?filter=elements HAS ANY C,Si,Ge AND nelements=2
4. https://jarvis.nist.gov/optimade/jarvisdft/v1/structures/?filter=chemical_formula_reduced=MoS2
5. https://jarvis.nist.gov/optimade/jarvisdft/v1/structures/?filter=chemical_formula_anonymous=A2B
6. https://jarvis.nist.gov/optimade/jarvisdft/v1/structures/?filter=nelements>=1



Example notebook

Reference 1: OPTIMADE, an API for exchanging materials data
Reference 2: Developments and applications of the OPTIMADE API for materials discovery, design, and data exchange

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