Computational Kinetics of Hydroperoxybutylperoxy Isomerizations and Decompositions: A Study of the Effect of Hydrogen Bonding-Reference-Cited by-同舟云学术

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Computational Kinetics of Hydroperoxybutylperoxy Isomerizations and Decompositions: A Study of the Effect of Hydrogen Bonding

Published:2018-07-08 Issue:30 Volume:122 Page:6277-6291
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Mohamed Samah Y.¹^ORCID,Davis Alexander C.²^ORCID,Al Rashidi Mariam J.³,Sarathy S. Mani¹^ORCID

Affiliation:

1. King Abdullah University of Science and Technology, Clean Combustion Research Center, Thuwal, 23955-6900, Saudi Arabia

2. Franklin and Marshall College, Lancaster, Pennsylvania 17604-3003, United States

3. University of Sharjah, Sharjah, P.O. Box 27272, United Arab Emirates

Funder

Saudi Aramco

King Abdullah University of Science and Technology

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.8b04415

Reference37 articles.

1. Detailed chemical kinetic models for the low-temperature combustion of hydrocarbons with application to gasoline and diesel fuel surrogates

2. Kinetics of elementary reactions in low-temperature autoignition chemistry

3. Unraveling the structure and chemical mechanisms of highly oxygenated intermediates in oxidation of organic compounds

4. Atmospheric chemistry of VOCs and NOx

5. Theoretical studies of atmospheric reaction mechanisms in the troposphere

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1. Systematic exploration of the thermochemistry for a set of peroxy hydroperoxy-alkyl radicals;Proceedings of the Combustion Institute;2024

2. Assessing the Isomerization of a Primary Intermediate (CH₃SCH₂O₂• Radical) in Dimethyl Sulfide Degradation in the Marine Boundary Layer;ACS Earth and Space Chemistry;2023-10-05

3. Elimination Reactions;Organic Reaction Mechanisms Series;2021-08-27

4. Understanding how chemical structure affects ignition-delay-time ϕ-sensitivity;Combustion and Flame;2021-03

5. H migration in peroxy radicals under atmospheric conditions;Atmospheric Chemistry and Physics;2020-06-26

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