Research output: Contribution to journal › Article › peer-review
Reduced Chemical Kinetic Mechanism for Methyl Pentanoate Combustion. / Gerasimov, Ilya E.; Bolshova, Tatyana A.; Zaev, Ivan A. et al.
In: Energy and Fuels, Vol. 31, No. 12, 21.12.2017, p. 14129-14137.Research output: Contribution to journal › Article › peer-review
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TY - JOUR
T1 - Reduced Chemical Kinetic Mechanism for Methyl Pentanoate Combustion
AU - Gerasimov, Ilya E.
AU - Bolshova, Tatyana A.
AU - Zaev, Ivan A.
AU - Lebedev, Alexander V.
AU - Potapkin, Boris V.
AU - Shmakov, Andrey G.
AU - Korobeinichev, Oleg P.
PY - 2017/12/21
Y1 - 2017/12/21
N2 - A reduced mechanism for the combustion of methyl pentanoate (MPe), consisting of 330 elementary reactions involving 92 species, has been developed based on the previously proposed combustion mechanism for MPe using the Mechanism Workbench software. The reduced model has been validated against experimental data on the structure of burner-stabilized stoichiometric and fuel-rich MPe/O2/Ar flames at pressures of 20 Torr and 1 atm. The modeling results for the full and reduced mechanisms are in good agreement for major flame species and for most of the intermediates, including hydrogen, methane, methyl radical, ethylene, acetylene, propyne, butadiene, methyl propenoate, and other intermediates. The proposed kinetic model also was validated against experimental data on MPe/air flame propagation velocities and extinction strain rates at atmospheric pressure as well as the autoignition delay times of stoichiometric MPe and air mixtures at T = 815 K and pressures of p = 10-18 bar.
AB - A reduced mechanism for the combustion of methyl pentanoate (MPe), consisting of 330 elementary reactions involving 92 species, has been developed based on the previously proposed combustion mechanism for MPe using the Mechanism Workbench software. The reduced model has been validated against experimental data on the structure of burner-stabilized stoichiometric and fuel-rich MPe/O2/Ar flames at pressures of 20 Torr and 1 atm. The modeling results for the full and reduced mechanisms are in good agreement for major flame species and for most of the intermediates, including hydrogen, methane, methyl radical, ethylene, acetylene, propyne, butadiene, methyl propenoate, and other intermediates. The proposed kinetic model also was validated against experimental data on MPe/air flame propagation velocities and extinction strain rates at atmospheric pressure as well as the autoignition delay times of stoichiometric MPe and air mixtures at T = 815 K and pressures of p = 10-18 bar.
UR - http://www.scopus.com/inward/record.url?scp=85039068259&partnerID=8YFLogxK
U2 - 10.1021/acs.energyfuels.7b01907
DO - 10.1021/acs.energyfuels.7b01907
M3 - Article
AN - SCOPUS:85039068259
VL - 31
SP - 14129
EP - 14137
JO - Energy & Fuels
JF - Energy & Fuels
SN - 0887-0624
IS - 12
ER -
ID: 9400289