59
Views
13
CrossRef citations to date
0
Altmetric
Original Articles

Low and Intermediate Temperature Ethane Combustion Modeling

, &
Pages 95-122 | Received 27 Jul 1993, Accepted 21 Dec 1993, Published online: 27 Apr 2007

References

  • Anastasi , C. Brown , M. J. , Smith , D. B. and Waddington , D. J. ( 1987 ), Self-reactions in the gas phase , Joint meeting of the French and Italian sections of the Combustion Institute , 2 . 7.
  • Atkinson , R. , Baulch , D. L. , Cox , R. A. , Hampson , R. F. Jr. , Kerr , J. A. and Troe , J. ( 1989 ). Evaluated kinetic and photochemical data for atmospheric chemistry: Supplement III. J. Phys. Chem. Ref. Data , 18 , 881 .
  • Baldwin , A. C , Barker , J. R. , Golden , D. M. and Hendry , D. G. ( 1977 ). Photochemical smog. Rate parameters estimates and computer simulations. J. Phys. Chem. , 81:25 , 2483 – 2492 .
  • Baldwin , R. R. , Hopkins , D. E. , Malcolm , D. G. and Walker , R. W. ( 1984 ). Elementary reactions involved in the oxidation of ethylene. Oxidation Communications , 6 , No. 1–4 , 231 – 245 .
  • Baldwin , R. R. , Dean , C. E. , Honeyman , M. R. and Walker , R. W. ( 1986 ). Arrhenius parameters for the HO2 + C2H6 → C2H5 + H2O2 over the temperature range 400–500°C. J. Chem. Soc. Faraday Trans. I , 82 , 89 – 102 .
  • Baldwin , R. R. , Dean , C. E. and Walker , R. W. ( 1986 ). Relative rate study of the addition or HO2 radicals to C2H4 and C3H6 , J. Chem. Soc. Faraday Trans. 2 , 82 , 1445 – 1455 .
  • Barbieri , G. , Di Maio , F. P. and Lignola , P. G. ( 1990 ). On ethane combustion process modeling. XII Task Leaders Meeting IEA , Tokyo . 204 – 213 .
  • Batt , L. ( 1979 ). The gas phase decomposition of alkoxy radicals . Int. Journ. of Chem. Kin. , XI , 977 – 993 .
  • Benson , S. W. ( 1965 ). Effects of resonance and structure on the thermochemistry of organic peroxy radicals and the kinetics of combustion reactions , J. Am. Chem. Soc , 87:5 , 972 – 979 .
  • Benson , S. W. ( 1981 ). The kinetics and thermochemistry of chemical oxidation with application to combustion and flames* . Prog. Energy Comb. Sci. , 7 , 125 – 134 .
  • Benson , S. W. ( 1982 ). Cool flames and oxidation: mechanism, thermochemistry and kinetics. Oxydation Communications , 2 , No. 3–4 . 169 – 188 .
  • Cathonnet , M. , Gaillard , F. , Boettner , J C , Cambray , P. , Karmed , D. and Bellet , J. C. ( 1984 ). Experimental study and kinetic modelling of ethylene oxidation in tubular reactors. Twentieth Symp. (Int.) on Comb. , The Combustion Institute , 819 – 829 .
  • CEC Group on Kinetic Data for Combustion Modelling . ( 1988 ).
  • Chevalier , C , Warnatz , J. and Melenk , H. ( 1990 ). Automatic generation of reaction mechanism for description of oxidation of higher hydrocarbons. XII Task Leaders Meeting IEA. , Tokyo , 181 – 196 .
  • Cobos , C.J. and Troe , J. ( 1990 ). The dissociation-recombination system CH4 + M = CH3 + H + M: reevaluated experiments from 300 to 3000 K. Z. Phys. Chem. , (Neue Fotge), 167 , 129 – 149 .
  • Di Maio , F. P. ( 1992 ). Analisi e simulazione di processi chimici complessi mediante generazione automatica di reti cinetiche. , Ph. D. thesis, Department of Chemical Engineering, University of Naples “ Federico II ”, Italy .
  • Gray , P., F. R, S. , Griffiths , J. F. and Hasko , S. M. ( 1984 ). Ignitions, extinctions and thermokinetic oscillations accompanying the oxidation of ethane in an open system (continuously stirred tank reactor). Proc. Roy. Soc. Lond. , A 396 , 227 – 255 .
  • Griffiths , J. F. and Sykes , A. F. ( 1989 ). Numerical studies of a thermokinetic model for oscillatory cool flame and complex ignition phenomena in ethanal oxidation under well-stirred flowing conditions , Proc. Roy. Soc. London , A 422 . 289 – 310 .
  • Kaiser , E. W. , Westbrook , C. K. and Pitz , W. J. ( 1986 ). Acetaldehyde oxidation in the negative temperature coefficient regime: experimental and modeling results. Int. Journ. of Chem. Kinet. , 18 , 655 – 688 .
  • Levitskii , A. A. , Moshkina , R, I. , Polak , L. S. and Polyak , S. S. ( 1979 ). Mechanism of the oxidation of ethane. VI Mathematical modeling. Kinet. and Catalysis , 20 , 1111 – 1117 .
  • Lifshitz , A. and Ben-Hamou , H. ( 1981 ). Thermal reactions of cyclic ethers at high temperatures. Pyrolysis of ethylene oxide behind reflect shocks. Comb, and Flames , 43 , 221 – 227 .
  • Lignola , P. G. , Marzocchella , A. , Reverchon , E. and Savona , C. ( 1988 ). Low temperature ethane combustion process. XIII Meeting of Italian Section , The Combustion Institute, Como ( Italy ) , 150 – 154 .
  • Lightfoot , P. D. and Pilling , M.J. ( 1987 ). Temperature and pressure dependence of the rale constant for the addition of H to C2H4. J. Phys. Chem. , 91 , 3373 .
  • Mantashyan , A. A. , Khachatryan , L. A. , Niazyan , O. M. and Arsentyen , S. D. ( 1981 ). On the reactions of peroxy radicals in the slow combustion of methane and ethylene , Comb, and Flame , 43 , 221 – 227 .
  • Miller , J. A. and Bowman , C. T. ( 1989 ). Mechanism and modeling of nitrogen chemistry in combustion. Prog. Energy Comb. Sci. , 15 , 287 – 338 .
  • Moshkina , R. I. , Polyak , S. S. , Masterovoi , I. F. and Nalbandyan , A. B. ( 1973 ). Mechanism of the ethane oxidation, I. Phenomenology and kinetics of the slow reaction. Kinetika i Kataliz , 14 , No. 5 , 1105 – 1110 .
  • Moshkina , R. I. , Polyak , S. S. , Masterovoi , I. F. and Nalbandyan . A. B. ( 1974 ). Mechanism of the ethane oxidation. II. The effect of intermediates and final products on the slow reaction kinetics. Kinetika i Kataliz , 15 , No. 2 , 282 – 289 .
  • Moshkina , R. I. , Polyak , S. S. , Masterovoi , I. F. and Nalbandyan , A. B. ( 1975 ). Mechanism of the ethane oxidation. III. Oxidation kinetics in the negative temperature coefficient region of the reaction rate. Kinetika i Kataliz , 16 , No. 6 , 1377 – 1385 .
  • Moshkina , R. I. , Polyak , S. S. , Sokolova , N. A. and Nalbandyan , A. B. ( 1976 ). Mechanism of the oxidation of ethane. IV, Use of kinetic isotope method for establishment of sequence of the formation of the reaction products. Kinetika i Kataliz , 17 , No. 4 , 1057 – 1059 .
  • Moshkina , R. I. , Polyak , S. S. , Sokolova , N. A. and Nalbandyan , A. B. ( 1978 ). Mechanism of ethane oxidation. V. A study using the kinetic isotope method. Kinetika i Kataliz , 19 , No. 4 , 830 – 839 .
  • Niki , H. , Maker , P. D. , Savage , C. M. and Breltenbach , L. P. ( 1983 ). A Fourier transform infrared study of the kinetics and mechanism for the reaction HO + CH3OOH. J. Phys. Chem. , 87 , 2190 – 2193 .
  • Norton , T. S. and Dryer , F, L. ( 1990 ). Toward a comprehensive mechanism for methanol pyrolysis. Int. J. Chem. Kin. , 22 . 219 – 241 .
  • Pitz , W. J. , Wilk , R. D. , Westbrook , C. K. and Cernansky , N. P. ( 1988 ). The oxidation of n-Butane at low and intermediate temperatures: an experimental and modeling study. Spring Meeting of Western States Section , L.L.N.L. Preprint UCRL-98402, 1 – 17 .
  • Slagle , I. R. , Feng , Q. and Gutman , D. ( 1984 ). Kinetics of reaction of ethyl radicals with molecular oxygen from 294 to 1002 K. J. Phys. Chem. , 88 , 3648 – 3653 .
  • Slagle , I. R. , Gutman , D. , Davies , J. W. , Pilling , M.J. ( 1988 ). Study of the recombination reaction CH3 + CH3 = C2H6. 1. Experiment. J. Phys. Chem. , 92 , 2455 .
  • Stewart , P. H. , Larson , C. W. , Golden , D. M. ( 1989 ). Pressure and temperature dependence of reactions proceeding via a bound complex. 2. Application to 2CH3 = C2H5 + H. Combust. Flame , 75 , 25 .
  • Troe , J. ( 1988 ). Toward a quantitative understanding of elementary combustion reactions. Twenty-second Symp. (Int.) on Combustion , The Combustion Institute, 843 – 862 .
  • Tsang , W. , Hampson , R. F. ( 1986 ). Chemical kinetic data base for combustion chemistry. Part I. Methane and related compounds. , J. Phys. Chem., Ref. Data , 15 , 1087 .
  • Wagner , A. F , and Wardlaw , D. M. ( 1988 ). Study of recombination reaction CH3 + CH3 → C2H6. 2. Theory. J. Phys. Chem. , 92 , 2462 – 2471 .
  • Wagner , A. F. , Slagle , I. R. , Sarzynski , D. and Gutman , D. ( 1990 ). Experimental and theoretical studies of the C2H5 + O2 reaction kinetics. J. Phys. Chem. , 94 , 1853 – 1868 .
  • Warnatz , J. ( 1984 ). Combustion Chemistry , W. C. Gardiner , Ed., Springer-Verlag .
  • Warnatz , J. ( 1981 ). The structure of laminar alkane, and acetylene flames. Eighteenth Symp. (Int.) on Combustion , The Combustion Institute , 369 – 384 .
  • Westbrook , C. K. and Dryer . F. L. ( 1979 ). A comprehensive mechanism for methanol oxidation. Comb. Sci. and Tech. , 20 , 125 – 140 .
  • Westbrook , C. K. and Pitz , W. J. ( 1984 ). A comprehensive chemical kinetic reaction mechanism for oxidation and pyrolysis of propane and propene , Comb. Sci. and Tech. , 37 , 117 – 152 .
  • Westbrook , C. K. ( 1991 ). Private communication. ,
  • Wilk , R. D. , Cernansky , N. P. , Pitz , W. J. and Westbrook , C. K. ( 1989 ). Propene oxidation at low and intermediate temperatures: a detailed chemical kinetic study. Comb, and Flame , 77 , 145 – 170 .
  • Wilk , R. D. , Cernansky , N. P. and Cohen , R. S. ( 1986 ), The oxidation of propane at low and transition temperature. Comb. Science and Tech. , 49 , 41 – 78 .

Reprints and Corporate Permissions

Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?

To request a reprint or corporate permissions for this article, please click on the relevant link below:

Academic Permissions

Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?

Obtain permissions instantly via Rightslink by clicking on the button below:

If you are unable to obtain permissions via Rightslink, please complete and submit this Permissions form. For more information, please visit our Permissions help page.