C1-C16 HT + Soot + NOx mechanism (Version 2003, March 2020)

 

Kinetic mechanism (497 species, 24501 reactions)

Thermodynamics

Transport properties

List of species

 

How to cite it

Pejpichestakul, W., Ranzi, E., Pelucchi, M., Frassoldati, A., Cuoci, A., Parente, A., Faravelli, T., Examination of a soot model in premixed laminar flames at fuel-rich conditions (2019) Proceedings of the Combustion Institute, 37 (1), pp. 1013-1021, DOI: 10.1016/j.proci.2018.06.104

Ranzi, E., Frassoldati, A., Stagni, A., Pelucchi, M., Cuoci, A., Faravelli, T., Reduced kinetic schemes of complex reaction systems: Fossil and biomass-derived transportation fuels (2014) International Journal of Chemical Kinetics, 46 (9), pp. 512-542, DOI: 10.1002/kin.20867

Ranzi, E., Cavallotti, C., Cuoci, A., Frassoldati, A., Pelucchi, M., Faravelli, T., New reaction classes in the kinetic modeling of low temperature oxidation of n-alkanes (2015) Combustion and Flame, 162 (5), pp. 1679-1691, DOI: 10.1016/j.combustflame.2014.11.030

 

References for soot

Pejpichestakul W., Cuoci, A., Frassoldati, A., Pelucchi, M., Parente, A., Faravelli, T., Buoyancy effect in sooting laminar premixed ethylene flame (2019) Combustion and Flame, 205, pp. 135-146, DOI: 10.1016/j.combustflame.2019.04.001

Saggese, C., Ferrario, S., Camacho, J., Cuoci, A., Frassoldati, A., Ranzi, E., Wang, H., Faravelli, T., Kinetic modeling of particle size distribution of soot in a premixed burner-stabilized stagnation ethylene flame, Combustion and Flame, 162(9), pp. 3356–3369 (2015), DOI: 10.1016/j.combustflame.2015.06.002

Saggese, C., Cuoci, A., Frassoldati, A., Ferrario, S., Camacho, J., Wang, H., Faravelli, T., Probe effects in soot sampling from a burner-stabilized stagnation flame (2016) Combustion and Flame, 167, pp. 184-197, DOI: 10.1016/j.combustflame.2016.02.013

 

References for NOx

T. Faravelli, A.Frassoldati and E. Ranzi, Kinetic modeling of the interactions between NO and hydrocarbons in the oxidation of hydrocarbons at low temperatures, Combustion and Flame, 132(1-2), pp. 188 - 207 (2003), doi:10.1016/S0010-2180(02)00437-6

A. Frassoldati, T. Faravelli and E. Ranzi, Kinetic modeling of the interactions between NO and hydrocarbons at high temperature, Combustion and Flame 135, pp. 97-112 (2003), doi:10.1016/S0010-2180(03)00152-4

 

References

Kéromnès, Alan, et al. "An experimental and detailed chemical kinetic modeling study of hydrogen and syngas mixture oxidation at elevated pressures." Combustion and Flame 160.6 (2013): 995-1011

Metcalfe, Wayne K., et al. "A hierarchical and comparative kinetic modeling study of C1− C2 hydrocarbon and oxygenated fuels." International Journal of Chemical Kinetics 45.10 (2013): 638-675

Burke, Sinéad M., et al. "An experimental and modeling study of propene oxidation. Part 1: Speciation measurements in jet-stirred and flow reactors." Combustion and Flame 161.11 (2014): 2765-2784

 

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