"DeePKS-kit: A package for developing machine learning-based chemically ..."

Yixiao Chen et al. (2023)

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DOI: 10.1016/J.CPC.2022.108520

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type: Journal Article

metadata version: 2023-08-28

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Yixiao Chen, Linfeng Zhang, Han Wang, Weinan E:
DeePKS-kit: A package for developing machine learning-based chemically accurate energy and density functional models. Comput. Phys. Commun. 282: 108520 (2023)

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