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Mathematical Modelling of Gas-Phase Complex Reaction Systems: Pyrolysis and Combustion
Charles K. Westbrook and Henry J. Curran Computer Aided Chemical Engineering, Mathematical Modelling of Gas-Phase Complex Reaction Systems: Pyrolysis and Combustion 45 363 (2019) https://doi.org/10.1016/B978-0-444-64087-1.00007-3
Influence of Different Core Mechanisms on Low-Temperature Combustion Characteristics of Large Hydrocarbon Fuels
Advanced Biofuels and Beyond: Chemistry Solutions for Propulsion and Production
Walter Leitner, Jürgen Klankermayer, Stefan Pischinger, Heinz Pitsch and Katharina Kohse‐Höinghaus Angewandte Chemie International Edition 56(20) 5412 (2017) https://doi.org/10.1002/anie.201607257
Hydroperoxide Measurements During Low-Temperature Gas-Phase Oxidation of n-Heptane and n-Decane
Synthese, motorische Verbrennung, Emissionen: Chemische Aspekte des Kraftstoffdesigns
Walter Leitner, Jürgen Klankermayer, Stefan Pischinger, Heinz Pitsch and Katharina Kohse‐Höinghaus Angewandte Chemie 129(20) 5500 (2017) https://doi.org/10.1002/ange.201607257
Thermal cracking of n-butylcyclohexane at high pressure (100 bar)—Part 2: Mechanistic modeling
Darwin A. Rakotoalimanana, Roda Bounaceur, Françoise Béhar, Valérie Burklé-Vitzthum and Paul-Marie Marquaire Journal of Analytical and Applied Pyrolysis 120 174 (2016) https://doi.org/10.1016/j.jaap.2016.05.003
Pyrolysis and combustion chemistry of tetrahydropyran: Experimental and modeling study
A Hierarchical and Comparative Kinetic Modeling Study of C1 − C2 Hydrocarbon and Oxygenated Fuels
Wayne K. Metcalfe, Sinéad M. Burke, Syed S. Ahmed and Henry J. Curran International Journal of Chemical Kinetics 45(10) 638 (2013) https://doi.org/10.1002/kin.20802
Cleaner Combustion
Edward Blurock, Frédérique Battin-Leclerc, Tiziano Faravelli and William H. Green Green Energy and Technology, Cleaner Combustion 59 (2013) https://doi.org/10.1007/978-1-4471-5307-8_3
Local CFD kinetic model of cadmium vaporization during fluid bed incineration of municipal solid waste
Modeling study of the low-temperature oxidation of large methyl esters from C11 to C19
Olivier Herbinet, Joffrey Biet, Mohammed Hichem Hakka, et al. Proceedings of the Combustion Institute 33(1) 391 (2011) https://doi.org/10.1016/j.proci.2010.07.060
Roda Bounaceur, Oliver Herbinet, Rene Fournet, Pierre-Alexandre Glaude, Frederique Battin-Leclerc, Antonio Pires da Cruz, Mohammed Yahyaoui, Karine Truffin and Gladys Moreac 1 (2010) https://doi.org/10.4271/2010-01-0546
Development and testing of a detailed kinetic mechanism of natural gas combustion in internal combustion engine
M. H. Hakka, H. Bennadji, J. Biet, M. Yahyaoui, B. Sirjean, V. Warth, L. Coniglio, O. Herbinet, P. A. Glaude, F. Billaud and F. Battin‐Leclerc International Journal of Chemical Kinetics 42(4) 226 (2010) https://doi.org/10.1002/kin.20473
Lean methane premixed laminar flames doped by components of diesel fuel II: n-Propylcyclohexane
An experimental and kinetic modeling study of the autoignition of α-methylnaphthalene/air and α-methylnaphthalene/n-decane/air mixtures at elevated pressures
Influence of EGR compounds on the oxidation of an HCCI-diesel surrogate
J.M. Anderlohr, A. Piperel, A. Pires da Cruz, R. Bounaceur, F. Battin-Leclerc, P. Dagaut and X. Montagne Proceedings of the Combustion Institute 32(2) 2851 (2009) https://doi.org/10.1016/j.proci.2008.06.019
A study on thermal combustion of lean methane–air mixtures: Simplified reaction mechanism and kinetic equations
Krzysztof Gosiewski, Anna Pawlaczyk, Krzysztof Warmuzinski and Manfred Jaschik Chemical Engineering Journal 154(1-3) 9 (2009) https://doi.org/10.1016/j.cej.2009.03.045
Mechanisms and Kinetics of Methane Thermal Conversion in a Syngas
Anthony Dufour, Sylvie Valin, Pierre Castelli, et al. Industrial & Engineering Chemistry Research 48(14) 6564 (2009) https://doi.org/10.1021/ie900343b
Experimental and Modeling Study of the Low-Temperature Oxidation of Large Alkanes
Joffrey Biet, Mohammed Hichem Hakka, Valérie Warth, Pierre-Alexandre Glaude and Frédérique Battin-Leclerc Energy & Fuels 22(4) 2258 (2008) https://doi.org/10.1021/ef8000746
An Experimental and Kinetic Modeling Study of the Oxidation of the Four Isomers of Butanol
Jeffrey T. Moss, Andrew M. Berkowitz, Matthew A. Oehlschlaeger, et al. The Journal of Physical Chemistry A 112(43) 10843 (2008) https://doi.org/10.1021/jp806464p
A shock tube study of cyclopentane and cyclohexane ignition at elevated pressures
Shane M. Daley, Andrew M. Berkowitz and Matthew A. Oehlschlaeger International Journal of Chemical Kinetics 40(10) 624 (2008) https://doi.org/10.1002/kin.20353
Rich methane premixed laminar flames doped by light unsaturated hydrocarbons
Experimental and modeling study of the autoignition of cyclopentene
M. Yahyaoui, M. H. Hakka, P. A. Glaude and F. Battin‐Leclerc International Journal of Chemical Kinetics 40(1) 25 (2008) https://doi.org/10.1002/kin.20290
Detailed chemical kinetic models for the low-temperature combustion of hydrocarbons with application to gasoline and diesel fuel surrogates
Detailed Kinetic Study of the Partial Oxidation of Methane over La2O3 Catalyst. Part 2: Mechanism
Matthieu Fleys, Yves Simon and Paul-Marie Marquaire Industrial & Engineering Chemistry Research 46(4) 1069 (2007) https://doi.org/10.1021/ie060343r
The autoignition of cyclopentane and cyclohexane in a shock tube
B. Sirjean, F. Buda, H. Hakka, P.A. Glaude, R. Fournet, V. Warth, F. Battin-Leclerc and M. Ruiz-Lopez Proceedings of the Combustion Institute 31(1) 277 (2007) https://doi.org/10.1016/j.proci.2006.07.247
Discussion on the oxidative and the pyrolysis routes of the CH3 radicals in the partial oxidation of methane over La2O3
Experimental and modeling study of the oxidation of xylenes
F. Battin‐Leclerc, R. Bounaceur, N. Belmekki and P. A. Glaude International Journal of Chemical Kinetics 38(4) 284 (2006) https://doi.org/10.1002/kin.20160
Experimental and modeling study of 1-hexene oxidation behind reflected shock waves
M. Yahyaoui, N. Djebaïli-Chaumeix, C.-E. Paillard, S. Touchard, R. Fournet, P.A. Glaude and F. Battin-Leclerc Proceedings of the Combustion Institute 30(1) 1137 (2005) https://doi.org/10.1016/j.proci.2004.08.070
Experimental and modeling study of the oxidation of toluene
R. Bounaceur, I. Da Costa, R. Fournet, F. Billaud and F. Battin‐Leclerc International Journal of Chemical Kinetics 37(1) 25 (2005) https://doi.org/10.1002/kin.20047
Modeling of the oxidation of large alkenes at low temperature
S. Touchard, R. Fournet, P.A. Glaude, V. Warth, F. Battin-Leclerc, G. Vanhove, M. Ribaucour and R. Minetti Proceedings of the Combustion Institute 30(1) 1073 (2005) https://doi.org/10.1016/j.proci.2004.07.004
Experimental and modeling study of the oxidation of 1‐pentene at high temperature
S. Touchard, F. Buda, G. Dayma, P. A. Glaude, R. Fournet and F. Battin‐Leclerc International Journal of Chemical Kinetics 37(8) 451 (2005) https://doi.org/10.1002/kin.20096
Shock tube measurements of branched alkane ignition times and OH concentration time histories
M. A. Oehlschlaeger, D. F. Davidson, J. T. Herbon and R. K. Hanson International Journal of Chemical Kinetics 36(2) 67 (2004) https://doi.org/10.1002/kin.10173
Experimental and modelling investigation of the thermal decomposition of n-dodecane
Application of Chemical Graph Theory for Automated Mechanism Generation
Artur Ratkiewicz and Thanh N. Truong Journal of Chemical Information and Computer Sciences 43(1) 36 (2003) https://doi.org/10.1021/ci020297f
Experimental and modeling study of the oxidation of benzene
I. Da Costa, R. Fournet, F. Billaud and F. Battin‐Leclerc International Journal of Chemical Kinetics 35(10) 503 (2003) https://doi.org/10.1002/kin.10148
Detailed chemical kinetic models for the combustion of hydrocarbon fuels
Direct measurements of the reaction H + CH2O → H2 + HCO behind shock waves by means of Vis–UV detection of formaldehyde
Gernot Friedrichs, David F. Davidson and Ronald K. Hanson International Journal of Chemical Kinetics 34(6) 374 (2002) https://doi.org/10.1002/kin.10059
An Experimental and Kinetic Study of Ethene Oxidation at a High Equivalence Ratio
S. Jallais, L. Bonneau, M. Auzanneau, V. Naudet and S. Bockel-Macal Industrial & Engineering Chemistry Research 41(23) 5659 (2002) https://doi.org/10.1021/ie010568w
Oxidation of small alkenes at high temperature
Barbara Heyberger, Najib Belmekki, Valérie Conraud, Pierre‐Alexandre Glaude, René Fournet and Frédérique Battin‐Leclerc International Journal of Chemical Kinetics 34(12) 666 (2002) https://doi.org/10.1002/kin.10092
Experimental and modeling study of the oxidation of 1‐butyne and 2‐butyne
N. Belmekki, P. A. Glaude, I. Da Costa, R. Fournet and F. Battin‐Leclerc International Journal of Chemical Kinetics 34(3) 172 (2002) https://doi.org/10.1002/kin.10035
Modeling the Oxidation of Mixtures of Primary Reference Automobile Fuels
R. Fournet, F. Battin‐Leclerc, P. A. Glaude, B. Judenherc, V. Warth, G. M. Côme, G. Scacchi, A. Ristori, G. Pengloan, P. Dagaut and M. Cathonnet International Journal of Chemical Kinetics 33(10) 574 (2001) https://doi.org/10.1002/kin.1053
Development and testing of a comprehensive chemical mechanism for the oxidation of methane
K. J. Hughes, T. Turányi, A. R. Clague and M. J. Pilling International Journal of Chemical Kinetics 33(9) 513 (2001) https://doi.org/10.1002/kin.1048
Comprehensive mechanism for the gas-phase oxidation of propene
Coal pyrolysis in a rotary kiln: Part II. Overall model of the furnace
Fabrice Patisson, Etienne Lebas, François Hanrot, Denis Ablitzer and Jean-Leon Houzelot Metallurgical and Materials Transactions B 31(2) 391 (2000) https://doi.org/10.1007/s11663-000-0057-4
Computer based generation of reaction mechanisms for gas-phase oxidation
The C2H5 + O2 Reaction Mechanism: High-Level ab Initio Characterizations
Jonathan C. Rienstra-Kiracofe, Wesley D. Allen and Henry F. Schaefer The Journal of Physical Chemistry A 104(44) 9823 (2000) https://doi.org/10.1021/jp001041k
Étude expérimentale et modélisation des réactions d’oxydation du néopentane et de l’isopentane
S Taconnet, Y Simon, G Scacchi and F Baronnet Canadian Journal of Chemistry 77(7) 1177 (1999) https://doi.org/10.1139/v99-077
Experimental and modeling of oxidation of acetylene, propyne, allene and 1,3-butadiene
Alison S. Tomlin, Tamás Turányi and Michael J. Pilling Comprehensive Chemical Kinetics, Low-Temperature Combustion and Autoignition 35 293 (1997) https://doi.org/10.1016/S0069-8040(97)80019-2
Computer-aided design of gas-phase oxidation mechanisms—Application to the modeling of n-heptane and iso-octane oxidation
Competition between gas and surface reactions in the oxidative coupling of methane 2. Isothermal experiments in a catalytic jet-stirred gas phase reactor