REANN: A PyTorch-based end-to-end multi-functional deep neural network package for molecular, reactive, and periodic systems.

Zhang, Yaolong; Xia, Junfan; Jiang, Bin

Zhang, Yaolong; Xia, Junfan; Jiang, Bin.

Afiliação

Zhang Y; School of Chemistry and Materials Science, Department of Chemical Physics, Key Laboratory of Surface and Interface Chemistry and Energy Catalysis of Anhui Higher Education Institutes, University of Science and Technology of China, Hefei, Anhui 230026, China.
Xia J; School of Chemistry and Materials Science, Department of Chemical Physics, Key Laboratory of Surface and Interface Chemistry and Energy Catalysis of Anhui Higher Education Institutes, University of Science and Technology of China, Hefei, Anhui 230026, China.
Jiang B; School of Chemistry and Materials Science, Department of Chemical Physics, Key Laboratory of Surface and Interface Chemistry and Energy Catalysis of Anhui Higher Education Institutes, University of Science and Technology of China, Hefei, Anhui 230026, China.

J Chem Phys ; 156(11): 114801, 2022 Mar 21.

Article em En | MEDLINE | ID: mdl-35317591

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: J Chem Phys Ano de publicação: 2022 Tipo de documento: Article País de afiliação: China

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