MaterialsAtlas Tutorial

NequIP Tutorials

nequipequivariantmliptutorialscomputational-materialsmaterials-education

NequIP tutorials for E(3)-equivariant neural network potentials, model training, validation, deployment, and atomistic simulation.

Citation: NequIP Tutorials. Materials tutorial resource. https://nequip.readthedocs.io/

Acknowledgement: Curated by MaterialsAtlas Open Resources from official documentation, tutorial collections, notebooks, workshop materials, and educational resources.

TypeTutorial
DomainGraph deep learning / MLIPs
LicenseTutorial / documentation; see source
Contributorsnequip.readthedocs.io