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Extreme Low-Temperature Combustion Chemistry: Ozone-Initiated Oxidation of Methyl Hexanoate

Aric C. Rousso, Ahren W. Jasper, Yiguang Ju, Nils Hansen

2020The Journal of Physical Chemistry A26 citationsDOIOpen Access PDF

Abstract

decomposition. The theoretical calculations show that the rate constants for methyl ester initiation via abstraction by O atoms increase dramatically with the size of the methyl ester, suggesting that ELTC is likely not important for the smaller methyl esters. Experimental evidence is provided indicating that, similar to the LTC regime, the chemistry in the ELTC regime is dominated by hydroperoxide chemistry. However, mass spectra recorded at various reactor temperatures and at different photon energies provide experimental evidence of some differences in chemical species between the ELTC and the LTC temperature ranges.

Topics & Concepts

ChemistryReactivity (psychology)OzoneAtmospheric temperature rangeIsomerizationStoichiometryAnalytical Chemistry (journal)Chemical reactionReaction rate constantPhotochemistryOrganic chemistryThermodynamicsKineticsCatalysisAlternative medicineMedicinePhysicsQuantum mechanicsPathologyAdvanced Combustion Engine TechnologiesCombustion and flame dynamicsCatalytic Processes in Materials Science
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