Experimental and detailed kinetic modeling of nitric oxide reduction by a natural gas blend in simulated reburning conditions

Citation
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
Citations number
23
Categorie Soggetti
Mechanical Engineering
Journal title
COMBUSTION SCIENCE AND TECHNOLOGY
ISSN journal
00102202 → ACNP
Volume
139
Issue
1-6
Year of publication
1998
Pages
329 - 363
Database
ISI
SICI code
0010-2202(1998)139:1-6<329:EADKMO>2.0.ZU;2-A
Abstract
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.