Data Science & Analytics
FAIR Simulation Packager
Create FAIR-minded reproducibility bundles for materials simulations by collecting input/output file inventories, hashes, units, engine versions, structure identifiers, provenance, and NOMAD/OPTIMADE/Materials Project friendly metadata. Use before publishing, sharing, archiving, or handing simulation results to another agent.
- Publisher / source
- HeshamFS/materials-simulation-skills (found on the CSV list)
- Upstream record
- HeshamFS/materials-simulation-skills
- Version
- Version 2
- Published
- Publication review
- Approved for publication
- Content fingerprint
2c6c439f8b9cc7a52b7cd3dbd9ed5dfaa00896cf7f4b21370c65473fb238b41f