Kinetic study of N-butane oxidation

Combustion Science and Technology

Volumn 65, Issue 4-6, 1989, Pages 207-230

  Chakir, A ^a   Cathonnet, M ^a   Boettner, J C ^a   Gaillard, F ^a  

^a CNRS   (France)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 84950017119     PISSN: 00102202     EISSN: 1563521X     Source Type: Journal    
DOI: 10.1080/00102208908924050     Document Type: Article

References (40)

1. Alfassi, Z. B., Golden, D. M., and Benson, S. W. (1973). The very low pressure dehydrogenation of cis-2-butene. The activation energy for 1, 4H elimination, Int. J. Chem. Kin. 5, 991.
2. Allara, D. L. and Schaw, R. (1980). A compilation of kinetic parameters for the thermal degradation of n-alcane molecules. J. Phys. Chem. Ref. Data 9, 523.
3. Atkinson, R. (1986). Estimations of OH radical rate constants for H atom abstraction from C-H and O-H bonds over 250–1000 K. Int. J. Chem. Kin., 18, 555.
4. Axelsson, E., Brezinsky, K., Dryer, F. L., Pitz, W. J., and Westbrook, C. K. (1987). Chemical kinetic modeling of the oxidation of large alkane fuels: n-octane and iso-octane. Twenty-first Symposium (International) on Combustion. The Combustion Institute, Pittsburgh, p. 783.
5. Bahn, G. S. (1973). Approximate Thermochemical Tables for some C-H and C-H-0 Species, NASA Report NASA-CR-2178.
6. ato slowly reacting mixtures of hydrogen and oxygen at 480°C. J. Chem. Soc. Faraday Trans. 1, 71, 736.
7. Boettner, J. C., Cathonnet, M., Dagaut, P., and Gaillard, F. (1988). Kinetic modelling of light hydrocarbons combustion. In Mathematical Modeling in Combustion and related Topics. NATO ASI Series, Series E: Applied Sciences, no. 140, p. 421, (C. M. Brauner and C. Schmidt-Lainé ed.), Martinus Nijhoff Publishers, Dordrecht.
8. 5alkanes. Comb. Flame 16, 29.
9. Burcat, A. (1984). Thermochemical data for combustion calculations. Combustion Chemistry, chap. 8, p. 455 (Gardiner, W. C., Jr., Ed.), Springer Verlag, New York.
10. Cathonnet, M., Boettner, J. C., and James, H. (1981). Experimental study and numerical modeling of high temperature oxidation of propane and n-butane. Eighteenth Symposium (International) on Combustion, The Combustion Institute, Pittsburgh, p. 903.
11. Cernansky, N. P., Green, R. M., Pitz, W. J., and Westbrook, C. K. (1986). Chemistry of fuel oxidation preceding end-gas autoignition. Comb. Sci. Technol. 50, 3.
12. Chakir, A. (1988). Etude cinetique et modelisation du mécanisme d'oxydation a haute temperature du n-butane et du 1-butene. These de l'Université Pierre et Marie Curie, Paris.
13. Chakir, A., Cathonnet, M., Boettner, J. C., and Gaillard, F. (1988). Kinetic study of 1-butene oxidation in a jet-stirred flow reactor. Twenty-second Symposium (International) on Combustion. The Combustion Institute, Pittsburgh, in press.
14. Cohen, N. (1982). The use of transition-state theory to extrapolate rate coefficients for reaction of OH with alkanes. Int. J. Chem. Kinet., 14, 1339.
15. Cohen, N. and Westberg, K. R. (1986). The use of transition-state theory to extrapolate rate coefficients for reactions of O atoms with alkanes. Int. J. Chem. Kinet., 18, 99.
16. Dagaut, P., Cathonnet, M., Rouan, J. P., Foulatier, R., Quilgars, A., Boettner, J. C., Gaillard, F., and James, H. (1986). A jet-stirred reactor for kinetic studies of homogeneous gas-phase reactions at pressures up to ten atmospheres. J. Phys E.: Sci. Instrum. 19, 207.
17. Dagaut, P., Cathonnet, M., Boettner, J. C., and Gaillard, F. (1987). Kinetic modeling of propane oxidation. Comb. Sci. Technol. 56, 23.
18. Dagaut, P., Cathonnet, M., Boettner, J. C., and Gaillard, F. (1988a). Kinetic modeling of ethylene oxidation. Comb. Flame 71, 291.
19. Dagaut, P., Cathonnet, M., and Boettner, J. C. (1988b). Experimental study and kinetic modeling of propene oxidation in a jet-stirred flow reactor. J. Phys. Chem. 92, 661.
20. Dente, M. E. and Ranzi, E. M. (1983). Mathematical modeling of hydrocarbon pyrolysis reactions. Pyrolysis, Theory and Industrial Practice, (L. F. Albright, B. L. Crynes and W. H. Corcoran Eds.), Academic Press, New York, chap. 7, p. 133.
21. Droege, A. T. and Tully, F. P. (1986). Hydrogen-atom abstraction from alkanes by OH. 5. n-Butane. J. Phys. Chem. 90, 5937.
22. Franck, J., Griffiths, J. F., and Nimo, W. (1988). The control of spontaneous ignition under rapid compression. Twenty-first Symposium (International) on Combustion, The Combustion Institute, Pittsburgh, 447.
23. Gaillard, F. and Gokalp, I. (1987). Some results on the structure of the temperature field in low Damköler number reaction zones. Proceedings of the 1987 France- US workshop on turbulent reacting flows, Springer-Verlag, in press.
24. 3P) with organic compounds. Progress in Reaction Kinetics, Pergamon Press, Oxford, Vol. 8. Part. 1, p. 1.
25. Kiefer, J. H. and Budach, K. A. (1984). The very high temperature pyrolysis of ethane: Evidence against high rates for dissociative recombination reactions of methyl radicals. Int. J. Chem. Kinet. 16, 679.
26. Liftshitz, A., Bauer, S. H., and Resler, E. L. (1963). Studies with a single-pulse shock tube. I. The cis-trans isomerization of butene-2. J. Chem. Phys. 38, 2056.
27. Pitz. W. J., Westbrook, C. K., Proscia, W. M. and Drycr, F. L. (1985). A comprehensive chemical kinetic reaction mechanism for the oxidation of n-butane. Twentieth Symposium (International) on Combustion, The Combustion Institute, Pittsburgh, p. 831.
28. Pitz, W. J. and Westbrook, C. K. (1986). Chemical kinetics of the high pressure oxidation of n-butane and its relation to engine knock. Comb. Flame 63, 113.
29. Schärfe, M., Ederer, H. J., Stabel, U., and Ebert, K. H. (1985). Modeling of n-hexane pyrolysis: Experimental investigation in a flow reactor at normal pressure. Ger. Chem. Eng. 8, 119.
30. Slagle, I., Qiao, F., and Gutman, D. (1984). Kinetics of the reaction of ethyl radicals with molecular oxygen from 294 to 1002 K. J. Phys. Chem. 88, 3648.
31. Sundaram, K. M., and Froment, G. F. (1978). Modeling of thermal cracking kinetics. 3. Radical mechanisms for the pyrolysis of simple paraffins, olefins and their mixtures. Ind. Engng. Chem. Fundam. 17, 174.
32. Tanzawa, T. and Gardiner, W. C., Jr. (1979). Thermal decomposition of acetylene. Seventeenth Symposium (International) on Combustion. The Combustion Institute, Pittsburgh, p. 563.
33. Walker, R. W. (1975), A critical survey of rate constants for reactions in gas-phase hydrocarbon oxidation. Reaction Kinetics, Specialist Periodical Report, (The Chemical Society, Ed.), London, Vol. 1, p. 161.
34. Walker, R. W. (1985). Temperature coefficients for reactions of OH radicals with alkanes between 300 and 1000 K. Int. J. Chem. Kinet. 17, 573.
35. Warnatz, J. (1981). The structure of laminar alkane-, alkene- and acetylene flames. Eighteenth Symposium (International) on Combustion, The Combustion Institute. Pittsburgh, p. 369.
36. Warnatz, J. (1983). The mechanism of high temperature combustion of propane and butane. Comb. Sci. Technol. 34, 177.
37. Warnatz, J. (1984). Rate coefficients in the C/H/O system. In Gardiner, W. C., Jr., (Ed.), Combustion Chemistry, Springer Verlag, New York, Chap. 5, p. 197.
38. Warnatz, J. (1985). Chemistry of high temperature combustion of alkanes up to octane. Twentieth Symposium (International) on Combustion, The Combustion Institute, Pittsburgh, p. 845.
39. Westbrook, C. K., Pitz, W. J., Thornton, M. M., and Malte, P. C. (1988a). A kinetic modeling study of n-pentane oxidation in a well-stirred reactor. Comb. Flame, 72, 45.
40. Westbrook, C. K., Warnatz, J., and Pitz, W. J. (1988b). A detailed chemical kinetic reaction mechanism for the oxidation of iso-octane and n-heptane over an extended temperature range and its application to analysis of engine knock. Twenty-second Symposium (International) on Combustion, The Combustion Institute, Pittsburgh, in press.