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dc.contributor.authorBaigmohammadi, Mohammadreza
dc.contributor.authorPatel, Vaibhav
dc.contributor.authorMartinez, Sergio
dc.contributor.authorPanigrahy, Snehasish
dc.contributor.authorRamalingam, Ajoy
dc.contributor.authorBurke, Ultan
dc.contributor.authorSomers, Kieran P.
dc.contributor.authorHeufer, Karl A.
dc.contributor.authorPekalski, Andrzej
dc.contributor.authorCurran, Henry J.
dc.date.accessioned2021-01-20T14:01:56Z
dc.date.issued2020-02-03
dc.identifier.citationBaigmohammadi, Mohammadreza, Patel, Vaibhav, Martinez, Sergio, Panigrahy, Snehasish, Ramalingam, Ajoy, Burke, Ultan, Somers, Kieran P., Heufer, Karl A., Pekalski, Andrzej, Curran, Henry J. (2020). A Comprehensive Experimental and Simulation Study of Ignition Delay Time Characteristics of Single Fuel C1–C2 Hydrocarbons over a Wide Range of Temperatures, Pressures, Equivalence Ratios, and Dilutions. Energy & Fuels, 34(3), 3755-3771. doi:10.1021/acs.energyfuels.9b04139en_IE
dc.identifier.issn1520-5029
dc.identifier.urihttp://hdl.handle.net/10379/16490
dc.description.abstractA comprehensive experimental and modeling study of the ignition delay time (IDT) characteristics of some single prominent C1–C2 hydrocarbons including methane, ethane, and ethylene has been performed over a wide range of temperatures (∼800–2000 K), pressures (∼1–80 bar), equivalence ratios (∼0.5–2.0), and dilutions (∼75–90%). An extensive literature review was conducted, and available data were extracted to create a comprehensive database used in our simulations. Based on existing literature data, an experimental matrix was designed using the Taguchi approach (L9) in order to identify and complete the experimental matrix required to generate a comprehensive validation set necessary for validation of a chemical kinetic model. The required IDTs were recorded using a high-pressure shock tube for shorter IDTs and a rapid compression machine for longer times, which encompass high- and low-temperature ranges, respectively. The predictions of a C3-NUIG mechanism have been compared with all of the available experimental data including those from the current study using the IDT simulations and the correlation technique. Moreover, individual and total effects of the studied parameters including pressure, equivalence ratio, and dilutions on IDT have been studied over a wide temperature range. Moreover, correlations which were developed based on the NUIG mechanism are presented for each specific fuel over the conditions studied. These correlations show acceptable performance versus the experimental Taguchi matrix data.en_IE
dc.description.sponsorshipThe authors would like to express their gratitude to Shell Research Ltd and Science Foundation Ireland (SFI) via their Research Centre Program through project number 16/SP/3829. The authors from PCFC, RWTH Aachen University would like to recognize the funding support from the German Research Foundation (Deutsche Forschungsgemeinschaft, DFG) through the Project Number 322460823 (HE7599/2-1).en_IE
dc.formatapplication/pdfen_IE
dc.language.isoenen_IE
dc.publisherAmerican Chemical Societyen_IE
dc.relation.ispartofEnergy & Fuelsen
dc.rightsAttribution-NonCommercial-NoDerivs 3.0 Ireland
dc.rights.urihttps://creativecommons.org/licenses/by-nc-nd/3.0/ie/
dc.subjectmethaneen_IE
dc.subjectethaneen_IE
dc.subjectethyleneen_IE
dc.subjectignition delay timeen_IE
dc.subjectsimulationsen_IE
dc.titleA comprehensive experimental and simulation study of ignition delay time characteristics of single fuel C1–C2 hydrocarbons over a wide range of temperatures, pressures, equivalence ratios, and dilutionsen_IE
dc.typeArticleen_IE
dc.date.updated2021-01-19T17:48:24Z
dc.identifier.doi10.1021/acs.energyfuels.9b04139
dc.local.publishedsourcehttps://doi.org/10.1021/acs.energyfuels.9b04139en_IE
dc.description.peer-reviewedpeer-reviewed
dc.contributor.funderShell Research Ltden_IE
dc.contributor.funderScience Foundation Irelanden_IE
dc.contributor.funderGerman Research Foundationen_IE
dc.description.embargo2021-02-03
dc.internal.rssid24437502
dc.local.contactHenry Curran, Dept Of Chemistry, Room 215, Arts/Science Building, Nui Galway. 3856 Email: henry.curran@nuigalway.ie
dc.local.copyrightcheckedYes
dc.local.versionACCEPTED
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Except where otherwise noted, this item's license is described as Attribution-NonCommercial-NoDerivs 3.0 Ireland