Reusable atomistic workflows with ontology-aligned metadata annotations that enable automatic provenance capture and FAIR data outputs for mechanical and thermodynamic properties including defects and nanoindentation.
w3.org/TR/rdf11-concepts/, W3C Recommendation
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Towards knowledge-based workflows: a semantic approach to atomistic simulations for mechanical and thermodynamic properties
Reusable atomistic workflows with ontology-aligned metadata annotations that enable automatic provenance capture and FAIR data outputs for mechanical and thermodynamic properties including defects and nanoindentation.