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Title: Anharmonic kinetics of the cyclopentane reaction with hydroxyl radical

Abstract

Quadratic–quartic bend anharmonicity and torsional anharmonicities play important roles in the kinetics of a cyclic hydrocarbon.

Authors:
ORCiD logo [1]; ORCiD logo [2]; ORCiD logo [1]; ORCiD logo [2]
  1. Department of Mechanical and Automation Engineering, Shenzhen Research Institute, The Chinese University of Hong Kong, New Territories, China
  2. Department of Chemistry, Chemical Theory Center and Supercomputing Institute, University of Minnesota, Minneapolis, USA
Publication Date:
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
OSTI Identifier:
1596884
Grant/Contract Number:  
SC0015997
Resource Type:
Published Article
Journal Name:
Chemical Science
Additional Journal Information:
Journal Name: Chemical Science; Journal ID: ISSN 2041-6520
Publisher:
Royal Society of Chemistry (RSC)
Country of Publication:
United Kingdom
Language:
English

Citation Formats

Wu, Junjun, Gao, Lu Gem, Ren, Wei, and Truhlar, Donald G. Anharmonic kinetics of the cyclopentane reaction with hydroxyl radical. United Kingdom: N. p., 2020. Web. doi:10.1039/C9SC05632G.
Wu, Junjun, Gao, Lu Gem, Ren, Wei, & Truhlar, Donald G. Anharmonic kinetics of the cyclopentane reaction with hydroxyl radical. United Kingdom. doi:10.1039/C9SC05632G.
Wu, Junjun, Gao, Lu Gem, Ren, Wei, and Truhlar, Donald G. Wed . "Anharmonic kinetics of the cyclopentane reaction with hydroxyl radical". United Kingdom. doi:10.1039/C9SC05632G.
@article{osti_1596884,
title = {Anharmonic kinetics of the cyclopentane reaction with hydroxyl radical},
author = {Wu, Junjun and Gao, Lu Gem and Ren, Wei and Truhlar, Donald G.},
abstractNote = {Quadratic–quartic bend anharmonicity and torsional anharmonicities play important roles in the kinetics of a cyclic hydrocarbon.},
doi = {10.1039/C9SC05632G},
journal = {Chemical Science},
number = ,
volume = ,
place = {United Kingdom},
year = {2020},
month = {1}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record
DOI: 10.1039/C9SC05632G

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