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Combustion Theory and Modelling Volume 9, 2005 - Issue 2
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Original Articles

First-principle calculation for the high-temperature diffusion coefficients of small pairs: the H–Ar Case

P. Middha Department of Mechanical Engineering, University of Delaware, Newark, DE, 19716, USA
&
H. Wang Department of Mechanical Engineering, University of Delaware, Newark, DE, 19716, USA; Now at Department of Aerospace and Mechanical Engineering, University of Southern California, Los Angeles, CA, 90089-1453, USA
Pages 353-363 | Published online: 20 Feb 2007

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Chung K. Law, Fujia Wu, Fokion N. Egolfopoulos, Vyaas Gururajan & Hai Wang. (2015) On the Rational Interpretation of Data on Laminar Flame Speeds and Ignition Delay Times. Combustion Science and Technology 187:1-2, pages 27-36.
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Articles from other publishers (29)

Sachin Kumar, Zichang Xiong, Julian Held, Peter Bruggeman & Uwe R. Kortshagen. (2023) Rapid carbon-free iron ore reduction using an atmospheric pressure hydrogen microwave plasma. Chemical Engineering Journal 472, pages 145025.
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James A. Miller, Raghu Sivaramakrishnan, Yujie Tao, C. Franklin Goldsmith, Michael P. Burke, Ahren W. Jasper, Nils Hansen, Nicole J. Labbe, Peter Glarborg & Judit Zádor. (2021) Combustion chemistry in the twenty-first century: Developing theory-informed chemical kinetics models. Progress in Energy and Combustion Science 83, pages 100886.
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Alan E. Long, Raymond L. Speth & William H. Green. (2019) Numerical investigation of strained extinction at engine-relevant pressures: Pressure dependence and sensitivity to chemical and physical parameters for methane-based flames. Combustion and Flame 202, pages 318-333.
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Yujie Tao, Gregory P. Smith & Hai Wang. (2018) Critical kinetic uncertainties in modeling hydrogen/carbon monoxide, methane, methanol, formaldehyde, and ethylene combustion. Combustion and Flame 195, pages 18-29.
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Paul J. Dagdigian, Jacek Kłos, Mick Warehime & Millard H. Alexander. (2016) Accurate transport properties for O(3 P )–H and O(3 P )–H2 . The Journal of Chemical Physics 145:16.
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Changran Liu, W. Sean McGivern, Jeffrey A Manion & Hai Wang. (2016) Theory and Experiment of Binary Diffusion Coefficient of n -Alkanes in Dilute Gases . The Journal of Physical Chemistry A 120:41, pages 8065-8074.
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Paul J. Dagdigian. (2016) Quantum Scattering Calculations of Transport Properties for the H–N 2 and H–CH 4 Collision Pairs . The Journal of Physical Chemistry A 120:40, pages 7793-7799.
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Okjoo Park, Peter S. Veloo, David A. Sheen, Yujie Tao, Fokion N. Egolfopoulos & Hai Wang. (2016) Chemical kinetic model uncertainty minimization through laminar flame speed measurements. Combustion and Flame 172, pages 136-152.
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Paul J. Dagdigian. (2015) Accurate transport properties for H–CO and H–CO2. The Journal of Chemical Physics 143:5.
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Paul J. Dagdigian. (2015) Combustion simulations with accurate transport properties for reactive intermediates. Combustion and Flame 162:6, pages 2480-2486.
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Okjoo Park, Peter S. Veloo, Hugo Burbano & Fokion N. Egolfopoulos. (2015) Studies of premixed and non-premixed hydrogen flames. Combustion and Flame 162:4, pages 1078-1094.
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Vincent Giovangigli. (2015) Multicomponent transport in laminar flames. Proceedings of the Combustion Institute 35:1, pages 625-637.
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Paul J. Dagdigian & Millard H. Alexander. (2014) Transport Properties for Systems with Deep Potential Wells: H + O 2 . The Journal of Physical Chemistry A 118:51, pages 11935-11942.
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Yuxuan Xin, David A. Sheen, Hai Wang & Chung K. Law. (2014) Skeletal reaction model generation, uncertainty quantification and minimization: Combustion of butane. Combustion and Flame 161:12, pages 3031-3039.
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Antonio L. Sánchez & Forman A. Williams. (2014) Recent advances in understanding of flammability characteristics of hydrogen. Progress in Energy and Combustion Science 41, pages 1-55.
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Quan-De Wang. (2014) An updated detailed reaction mechanism for syngas combustion. RSC Adv. 4:9, pages 4564-4585.
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Paul J. Dagdigian & Millard H. Alexander. (2013) Exact quantum scattering calculations of transport properties for the H2O–H system. The Journal of Chemical Physics 139:19.
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Alan Kéromnès, Wayne K. Metcalfe, Karl A. Heufer, Nicola Donohoe, Apurba K. Das, Chih-Jen Sung, Jürgen Herzler, Clemens Naumann, Peter Griebel, Olivier Mathieu, Michael C. Krejci, Eric L. Petersen, William J. Pitz & Henry J. Curran. (2013) An experimental and detailed chemical kinetic modeling study of hydrogen and syngas mixture oxidation at elevated pressures. Combustion and Flame 160:6, pages 995-1011.
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Chunsheng Ji, Runhua Zhao, Bo Li & Fokion N. Egolfopoulos. (2013) Propagation and extinction of cyclopentadiene flames. Proceedings of the Combustion Institute 34:1, pages 787-794.
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Michael P. Burke, Marcos Chaos, Yiguang Ju, Frederick L. Dryer & Stephen J. Klippenstein. (2012) Comprehensive H 2 /O 2 kinetic model for high-pressure combustion . International Journal of Chemical Kinetics 44:7, pages 444-474.
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Chunsheng Ji, Enoch Dames, Hai Wang & Fokion N. Egolfopoulos. (2012) Propagation and extinction of benzene and alkylated benzene flames. Combustion and Flame 159:3, pages 1070-1081.
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Chungsheng Ji, Yang L. Wang & Fokion N. Egolfopoulos. (2011) Flame Studies of Conventional and Alternative Jet Fuels. Journal of Propulsion and Power 27:4, pages 856-863.
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Chungsheng Ji, Yang L. Wang & Fokion N. Egolfopoulos. (2011) Flame Studies of Conventional and Alternative Jet Fuels. Journal of Propulsion and Power 27:4, pages 856-863.
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David A. Sheen & Hai Wang. (2011) Combustion kinetic modeling using multispecies time histories in shock-tube oxidation of heptane. Combustion and Flame 158:4, pages 645-656.
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Chunsheng Ji, Enoch Dames, Baptiste Sirjean, Hai Wang & Fokion N. Egolfopoulos. (2011) An experimental and modeling study of the propagation of cyclohexane and mono-alkylated cyclohexane flames. Proceedings of the Combustion Institute 33:1, pages 971-978.
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Chunsheng Ji & Fokion N. Egolfopoulos. (2011) Flame propagation of mixtures of air with binary liquid fuel mixtures. Proceedings of the Combustion Institute 33:1, pages 955-961.
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K. Narayanaswamy, G. Blanquart & H. Pitsch. (2010) A consistent chemical mechanism for oxidation of substituted aromatic species. Combustion and Flame 157:10, pages 1879-1898.
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Xiaoqing You, Fokion N. Egolfopoulos & Hai Wang. (2009) Detailed and simplified kinetic models of n-dodecane oxidation: The role of fuel cracking in aliphatic hydrocarbon combustion. Proceedings of the Combustion Institute 32:1, pages 403-410.
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A.T. Holley, X.Q. You, E. Dames, H. Wang & F.N. Egolfopoulos. (2009) Sensitivity of propagation and extinction of large hydrocarbon flames to fuel diffusion. Proceedings of the Combustion Institute 32:1, pages 1157-1163.
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