NEP Potential Database

The NEP Potential Database is a public resource platform for researchers in computational materials science, physical chemistry, and related fields. Its main purpose is to promote the adoption, validation, and collaboration of NEP models, providing efficient and reliable interaction description tools for cross-scale atomic simulations. Each potential comes with clear documentation and corresponding literature, explicitly stating its training data sources, element composition, and scope of application.

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Alkali Metal
Alkaline Earth
Transition Metal
Nonmetal
Halogen
Noble Gas
Lanthanide/Actinide

Potential List 0

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