MaterialsAtlas Software and Tool

KLIFF

potential-fittinginteratomic-potentialsopenkimmachine-learningcomputational-materials-softwaresoftware-tools

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KIM-based learning-integrated fitting framework for training and testing interatomic potentials.

Citation: KLIFF. Computational materials software/tool. https://github.com/openkim/kliff

Acknowledgement: Curated by MaterialsAtlas Open Resources from official project pages, documentation, and common computational materials workflows.

TypeSoftware and Tool

DomainPotential fitting

LicenseLGPL-2.1

Contributorsopenkim/kliff