Understanding Selective Hydrodeoxygenation of 1,2- and 1,3-Propanediols on Cu/Mo 2 C via Multiscale Modeling

You, Kyung-Eun; Ammal, Salai C.; Lin, Zhexi; Heyden, Andreas

doi:10.1021/acscatal.2c00261

Understanding Selective Hydrodeoxygenation of 1,2- and 1,3-Propanediols on Cu/Mo ₂ C via Multiscale Modeling

Journal Article · Mon Apr 04 00:00:00 EDT 2022 · ACS Catalysis

DOI:https://doi.org/10.1021/acscatal.2c00261· OSTI ID:1982008

You, Kyung-Eun ^[1]; Ammal, Salai C. ^[1]; ^[2]; ^[1]

Department of Chemical Engineering, University of South Carolina, Columbia, South Carolina 29208, United States
Department of Chemical Engineering, Columbia University, New York, New York 10027, United States

Not provided.

Research Organization:: Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States). National Energy Research Scientific Computing Center (NERSC)

Sponsoring Organization:: USDOE

DOE Contract Number:: AC02-05CH11231

OSTI ID:: 1982008

Journal Information:: ACS Catalysis, Journal Name: ACS Catalysis Journal Issue: 8 Vol. 12; ISSN 2155-5435

Publisher:: American Chemical Society (ACS)

Country of Publication:: United States

Language:: English

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