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dc.contributor.authorDarcy, Daniel
dc.contributor.authorTobin, Colin
dc.contributor.authorMetcalfe, Wayne
dc.contributor.authorPitz, William J.
dc.contributor.authorNakamura, Hisashi
dc.contributor.authorWestbrook, Charles K.
dc.contributor.authorCurran, Henry J.
dc.identifier.citationDarcy, D., Nakamura, H., Tobin, C. J., Mehl, M., Metcalfe, W. K., Pitz, W. J., . . . Curran, H. J. (2014). A high-pressure rapid compression machine study of n-propylbenzene ignition. Combustion and Flame, 161(1), 65-74.en_IE
dc.descriptionJournal articleen_IE
dc.description.abstractThis study presents new ignition delay data measured in a rapid compression machine over a wide range temperature, pressure and fuel/air ratio. This data is an extension of that measured previously (D. Darcy, C.J. Tobin, K. Yasunaga, J.M. Simmie, J. Wiirmel, T. Niass, O. Mathieu, S.S. Ahmed, C.K. Westbrook, H.J. Curran, Combust. Flame, 159 (2012) 2219-2232.) for the oxidation of n-propylbenzene in a high-pressure shock tube. The data was obtained for equivalence ratios of 0.29, 0.48, 0.96, and 1.92, at compressed gas pressures of 10, 30 and 50 atm, and over the temperature range of 650-1000 K. Experimental data was also obtained at 50 atm for all equivalence ratios in our new heated high-pressure shock tube and this is also presented here. Comparisons between the data obtained in both the rapid compression machine and the shock tube facilities showed excellent agreement. A previously published chemical kinetic mechanism has been improved and a low-temperature reaction mechanism has been added to simulate ignition delay times at the lower temperature conditions of this study by adding the appropriate species and reactions including alkyl-peroxyl and hydroperoxy-alkyl radical chemistry. Special attention was given to R(O) over dot(2) isomerizations and H(O) over dot(2) elimination reactions involving the secondary benzylic site on n-propylbenzene to obtain good agreement with the present experimental results. In general, good agreement was obtained between the model and experiments and consistent trends were observed and these are discussed.en_IE
dc.description.sponsorshipSaudi Aramcoen_IE
dc.publisherElsevier ScienceDirecten_IE
dc.relation.ispartofCombustion And Flameen
dc.subjectRapid compression machineen_IE
dc.subjectShock tubeen_IE
dc.subjectIgnition delay timesen_IE
dc.titleA high-pressure rapid compression machine study of n-propylbenzene ignitionen_IE
dc.local.contactHenry Curran, Dept Of Chemistry, Room 215, Arts/Science Building, Nui Galway. 3856 Email:

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