Bridging the complexity gap in computational heterogeneous catalysis with machine learning

Mou, Tianyou; Pillai, Hemanth Somarajan; Wang, Siwen; Wan, Mingyu; Han, Xue; Schweitzer, Neil M.; Che, Fanglin; Xin, Hongliang

doi:10.1038/s41929-023-00911-w

Bridging the complexity gap in computational heterogeneous catalysis with machine learning

Journal Article · 31 January 2023 · Nature Catalysis

DOI:https://doi.org/10.1038/s41929-023-00911-w· OSTI ID:2422229

Mou, Tianyou ^[1]; Pillai, Hemanth Somarajan; Wang, Siwen; Wan, Mingyu; Han, Xue; Schweitzer, Neil M.; ;

OSTI

Not provided.

Research Organization:: Virginia Polytechnic Inst. and State Univ. (Virginia Tech), Blacksburg, VA (United States)

Sponsoring Organization:: USDOE Office of Science (SC)

DOE Contract Number:: SC0023323

OSTI ID:: 2422229

Journal Information:: Nature Catalysis, Journal Name: Nature Catalysis Journal Issue: 2 Vol. 6; ISSN 2520-1158

Publisher:: Springer Nature

Country of Publication:: United States

Language:: English

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