Molecular Dynamics Simulation of C–C Bond Scission in Polyethylene and Linear Alkanes: Effects of the Condensed Phase
Author:
Affiliation:
1. Research Center for Chemical Kinetics, Department of Chemistry, The Catholic University of America, Washington, DC 20064, United States
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp411474u
Reference27 articles.
1. Reexamination of the Pyrolysis of Polyethylene: Data Needs, Free-Radical Mechanistic Considerations, and Thermochemical Kinetic Simulation of Initial Product-Forming Pathways
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