Understanding and Representing the Distinct Kinetics Induced by Reactive Collisions of Rovibrationally Excited Ephemeral Complexes across Reactive Collider Mole Fractions and Pressures-Reference-Cited by-同舟云学术

Understanding and Representing the Distinct Kinetics Induced by Reactive Collisions of Rovibrationally Excited Ephemeral Complexes across Reactive Collider Mole Fractions and Pressures

Published:2020-12-16 Issue:52 Volume:124 Page:10937-10953
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Lei Lei¹^ORCID,Burke Michael P.¹²^ORCID

Affiliation:

1. Department of Mechanical Engineering, Columbia University, New York, New York 10027, United States

2. Department of Chemical Engineering, Data Science Institute, Columbia University, New York, New York 10027, United States

Funder

Division of Chemical, Bioengineering, Environmental, and Transport Systems

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.0c08690

Reference49 articles.

1. Kee, R. J.; Rupley, F. M.; Miller, J. A. Chemkin-II: A Fortran Chemical Kinetics Package for the Analysis of Gas-Phase Chemical Kinetics; Sandia National Lab, 1989.

2. OpenSMOKE++: An object-oriented framework for the numerical modeling of reactive systems with detailed kinetic mechanisms

3. Pitsch, H. FlameMaster: A C++ Computer Program for 0D Combustion and 1D Laminar Flame Calculations, 1998.

4. Ephemeral collision complexes mediate chemically termolecular transformations that affect system chemistry

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