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Title: A Comparative Ab Initio Study of Anhydrous Dehydrogenation of Linear-Chain Alcohols on Cu(110)

Authors:
ORCiD logo; ; ORCiD logo; ; ; ORCiD logo;
Publication Date:
Research Org.:
Oak Ridge National Laboratory, Oak Ridge Leadership Computing Facility (OLCF); Energy Frontier Research Centers (EFRC) (United States). Integrated Mesoscale Architectures for Sustainable Catalysis (IMASC)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
OSTI Identifier:
1470258
DOE Contract Number:  
SC0012573
Resource Type:
Journal Article
Journal Name:
Journal of Physical Chemistry. C
Additional Journal Information:
Journal Volume: 122; Journal Issue: 14; Related Information: IMASC partners with Harvard University (lead); Fritz Haber Institute; Lawrence Berkeley National Laboratory; Lawrence Livermore National Laboratory; University of Kansas; Tufts University; Journal ID: ISSN 1932-7447
Publisher:
American Chemical Society
Country of Publication:
United States
Language:
English
Subject:
catalysis (heterogeneous), mesostructured materials, materials and chemistry by design, synthesis (novel materials)

Citation Formats

Chen, Wei, Cubuk, Ekin Dogus, Montemore, Matthew M., Reece, Christian, Madix, Robert J., Friend, Cynthia M., and Kaxiras, Efthimios. A Comparative Ab Initio Study of Anhydrous Dehydrogenation of Linear-Chain Alcohols on Cu(110). United States: N. p., 2018. Web. doi:10.1021/acs.jpcc.8b01698.
Chen, Wei, Cubuk, Ekin Dogus, Montemore, Matthew M., Reece, Christian, Madix, Robert J., Friend, Cynthia M., & Kaxiras, Efthimios. A Comparative Ab Initio Study of Anhydrous Dehydrogenation of Linear-Chain Alcohols on Cu(110). United States. doi:10.1021/acs.jpcc.8b01698.
Chen, Wei, Cubuk, Ekin Dogus, Montemore, Matthew M., Reece, Christian, Madix, Robert J., Friend, Cynthia M., and Kaxiras, Efthimios. Tue . "A Comparative Ab Initio Study of Anhydrous Dehydrogenation of Linear-Chain Alcohols on Cu(110)". United States. doi:10.1021/acs.jpcc.8b01698.
@article{osti_1470258,
title = {A Comparative Ab Initio Study of Anhydrous Dehydrogenation of Linear-Chain Alcohols on Cu(110)},
author = {Chen, Wei and Cubuk, Ekin Dogus and Montemore, Matthew M. and Reece, Christian and Madix, Robert J. and Friend, Cynthia M. and Kaxiras, Efthimios},
abstractNote = {},
doi = {10.1021/acs.jpcc.8b01698},
journal = {Journal of Physical Chemistry. C},
issn = {1932-7447},
number = 14,
volume = 122,
place = {United States},
year = {2018},
month = {3}
}