P. Dagaut et al., Experimental and detailed kinetic modeling of nitric oxide reduction by a natural gas blend in simulated reburning conditions, COMB SCI T, 139(1-6), 1998, pp. 329-363
The reduction of nitric oxide (NO) in simulated conditions of the reburning
zone has been studied in a fused silica jet-stirred reactor operating at a
tmospheric pressure, in the temperature range 1100-1500 K, in diluted condi
tions. A mixture of CH4 and C2H6 (10:1), a natural gas blend, was used as r
eburning fuel. The initial mole fractions of NO, hydrocarbon and H2O have b
een varied as well as the temperature, and the equivalence ratio. From the
present study it was demonstrated that the NO reduction potential varies as
the temperature, the initial mole fraction of reburning fuel, and that the
initial mole fraction of NO has only a minor effect on the reduction of NO
when the reduction of NO is high. In conditions where the reduction of NO
is low, the efficiency of the process tends to moderately increase with the
initial concentration of NO. Optimal conditions for the reburning of NO ca
n be obtained for particular combinations of equivalence ratio and temperat
ure. These results, which clarify the influence of these important paramete
rs on the kinetics of NO reburning, are generally in agreement with previou
s investigations. A detailed chemical kinetic modeling of the present exper
iments was performed (786 reversible reactions and 113 species). An overall
reasonable agreement between the present data and the modeling was obtaine
d although improvements of the model are still needed. The main route to NO
reduction involves ketenyl radical. The model indicates that the reaction
path: HCCO + NO --> HCNO + CO followed by HCNO + H --> HCN + OH is responsi
ble for the occurrence of a minima for TFN at phi similar or equal to 1.25.
According to the present modeling, the reduction of NO by CH4/C2H6 mix can
be summarized as: HCCO + NO --> HCNO -->, HCN --> NCO -->,HNCO --> NHi; NH
i + NO --> N-2; NH + NO --> N2O; N2O + M,H --> N-2.