figshare
Browse
1/1
11 files

Assessing the Impact of Roaming Radical Reactions on Combustion Properties of Transportation Fuels

Download all (18.12 MB)
dataset
posted on 2017-08-03, 15:34 authored by Richard WestRichard West, Franklin GoldsmithFranklin Goldsmith
Scripts, data, models, and results to generate kinetic models, simulations, and figures for a manuscript assessing the impact of including roaming radical reactions in detailed kinetic models of combustion of transportation-relevant fuels.
Source code in the form of Python Jupyter Notebooks, necessary input files, and the resulting figures are all included.

Funding

National Science Foundation grants no. 1403171 and 1605568

History

Usage metrics

    Categories

    Keywords

    roamingradicalcombustionFree Radical ChemistryComputational ChemistryAutomotive Combustion and Fuel Engineering (incl. Alternative/Renewable Fuels)Non-automotive Combustion and Fuel Engineering (incl. Alternative/Renewable Fuels)Reaction Kinetics and DynamicsCatalysis and Mechanisms of ReactionsTheoretical and Computational Chemistry not elsewhere classified

    Licence

    CC BY 4.0

    Exports

    RefWorks
    BibTeX
    Ref. manager
    Endnote
    DataCite
    NLM
    DC