MaterialsAtlas Model

CHGNet

chgnetuniversal-mlipcharge-informedrelaxationai-materials-modelopen-modelmaterials-foundation-models

Charge-informed graph neural network universal potential for energy, force, stress, magnetic moments, relaxation, and molecular dynamics.

Citation: CHGNet. AI materials model resource. https://github.com/CederGroupHub/chgnet

Acknowledgement: Curated by MaterialsAtlas Open Resources from public repositories, model cards, preprints, and project documentation.

TypeModel
DomainRelaxation / ML interatomic potential
LicenseBSD-3-Clause
ContributorsCederGroupHub/chgnet