Experimental Assessment of Naphthalene Formation Mechanisms in Non-Premixed Flames

Concentration profiles of stable hydrocarbons were measured along the centerline of several antisymmetric co-flowing methane/air non-prcmixed flames whose fuels were doped with 2500 to 1900 ppm of benzene, toluene, elhylbenzene. styrene. and phenylacctylene. The results indicate that the H-abstraction/C2H2,-addition mechanism proposed by Frenklach and co-workers was responsible for the naphthalene formed in the undoped, benzene-, styrene-, and phenylacetylene-doped flames. However, a second source of naphthalene, possibly a reaction between benzyl and propargyl radicals, was important in the toluene- and ethylbenzene-doped flames. Soot volume fractions were also measured in each flame; the maximum values correlated well with the maximum naphthalene concentrations, indicating that naphthalene formation is the critical soot formation step for these fuel mixtures containing one-ring compounds.

[1]  C. McEnally,et al.  Species and soot concentration measurements in a methane/air nonpremixed flame doped with C4 hydrocarbons , 1998 .

[2]  C. McEnally,et al.  Soot formation in methane/air nonpremixed flames doped with small quantities of C3 hydrocarbons , 1998 .

[3]  D. E. Rosner,et al.  Soot volume fraction and temperature measurements in laminar nonpremixed flames using thermocouples , 1997 .

[4]  C. McEnally,et al.  Aromatic and Linear Hydrocarbon Concentration Measurements in a Non-Premixed Flame , 1996 .

[5]  C. Westbrook,et al.  Modeling of Aromatic and Polycyclic Aromatic Hydrocarbon Formation in Premixed Methane and Ethane Flames , 1996 .

[6]  K. M. Leung,et al.  Detailed Kinetic Modeling of C, - C, Alkane Diffusion Flames , 1995 .

[7]  M. Castaldi,et al.  MICRO-STRUCTURES OF PREMIXED HYDROCARBON FLAMES: METHANE , 1995 .

[8]  M. Frenklach,et al.  Detailed modeling of soot formation in laminar premixed ethylene flames at a pressure of 10 bar , 1995 .

[9]  L. Pfefferle,et al.  Laser ionization time-of-flight mass spectrometry combined with residual gas analysis for the investigation of moderate temperature benzene oxidation☆ , 1995 .

[10]  Fabian Mauss,et al.  Inception and growth of soot particles in dependence on the surrounding gas phase , 1994 .

[11]  M. Colket,et al.  Reaction mechanisms for toluene pyrolysis , 1994 .

[12]  Michael Frenklach,et al.  A computational study of sooting limits in laminar premixed flames of ethane, ethylene, and acetylene☆ , 1993 .

[13]  M. Frenklach,et al.  Detailed modeling of soot particle nucleation and growth , 1991 .

[14]  N. Peters,et al.  A flamelet calculation of benzene formation in coflowing laminar diffusion flames , 1991 .

[15]  David T. Anderson,et al.  Mechanistic studies of toluene destruction in diffusion flames , 1990 .

[16]  I. Glassman Soot formation in combustion processes , 1989 .

[17]  J. Longwell,et al.  Identification of aromatic alkynes and acyclic polyunsaturated hydrocarbons in the output of a jet-stirred combustor , 1988 .

[18]  J. Troe,et al.  Thermal decomposition of ethylbenzene, styrene, and bromophenylethane: UV absorption study in shock waves , 1988 .

[19]  D. A. Sullivan,et al.  Gas-Phase Ion and Neutral Thermochemistry , 1988 .

[20]  Michael G. Littman,et al.  Comparative study of soot formation on the centerline of axisymmetric laminar diffusion flames: Fuel and temperature effects , 1987 .

[21]  Robert J. Santoro,et al.  The Transport and Growth of Soot Particles in Laminar Diffusion Flames , 1987 .

[22]  Michael Frenklach,et al.  Detailed Modeling of PAH Profiles in a Sooting Low-Pressure Acetylene Flame , 1987 .

[23]  David E. Keyes,et al.  Numerical Solution of Two-Dimensional Axisymmetric Laminar Diffusion Flames , 1986 .

[24]  J. Kiefer,et al.  The high temperature pyrolysis of ethylbenzene: Evidence for dissociation to benzyl and methyl radicals , 1986 .

[25]  D. E. Rosner,et al.  Experimental studies of soot particle thermophoresis in nonisothermal combustion gases using thermocouple response techniques , 1985 .

[26]  J. Kiefer,et al.  A shock tube investigation of major pathways in the high-temperature pyrolysis of benzene , 1985 .

[27]  A. Sarofim,et al.  Polycyclic aromatic hydrocarbons formation and destruction in a laminar diffusion flame , 1985 .

[28]  Stephen E. Stein,et al.  Detailed kinetic modeling of soot formation in shock-tube pyrolysis of acetylene , 1985 .

[29]  George Sidebotham,et al.  Sooting behavior in temperature-controlled laminar diffusion flames☆ , 1984 .

[30]  F. G. Roper Soot Escape from Diffusion Flames: A Comparison of Recent Work in this Field , 1984 .

[31]  K. Brezinsky,et al.  The high-temperature oxidation of aromatic hydrocarbons , 1986 .

[32]  D. Golden,et al.  Hydrocarbon Bond Dissociation Energies , 1983 .

[33]  Richard D. Smith A direct mass spectrometric study of the mechanism of toluene pyrolysis at high temperatures , 1979 .

[34]  R. C. Weast CRC Handbook of Chemistry and Physics , 1973 .

[35]  A. G. Entwistle,et al.  Determination of the emissivity, for total radiation, of small diameter platinum-10% rhodium wires in the temperature range 600-1450°C , 1961 .