Atomistic neural network representations for chemical dynamics simulations of molecular, condensed phase, and interfacial systems: Efficiency, representability, and generalization (IMAGE)

University of Science and Technology of China

Atomistic neural network representations for chemical dynamics simulations of molecular, condensed phase, and interfacial systems: Efficiency, representability, and generalization

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The framework of AtNN.

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Image by ZHANG Yaolong et al.

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