ReaxFF MD Investigation of the High-Temperature Combustion of Six Octane Isomers
Author:
Affiliation:
1. State Key Laboratory of Chemical Engineering, School of Chemical Engineering, East China University of Science and Technology, Shanghai 200237, China
2. School of Chemistry & Chemical Engineering, XinJiang University, Urumqi 830046, China
Funder
National Natural Science Foundation of China
Publisher
American Chemical Society (ACS)
Subject
Energy Engineering and Power Technology,Fuel Technology,General Chemical Engineering
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.energyfuels.1c02462
Reference45 articles.
1. Assessment of the Thermophysical Properties of Thermally Stressed RP-1 and RP-2
2. Revealing the Initial Chemistry of Soot Nanoparticle Formation by ReaxFF Molecular Dynamics Simulations
3. A Wide-Range Kinetic Modeling Study of Oxidation and Combustion of Transportation Fuels and Surrogate Mixtures
4. Product Identification and Mass Spectrometric Analysis of n‐Butane and i‐Butane Pyrolysis at Low Pressure
5. Recent progress in the development of diesel surrogate fuels
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