NO mechanisms of syngas MILD combustion diluted with N2, CO2, and H2O

The NO mechanism under the moderate or intense low-oxygen dilution (MILD) combustion of syngas has not been systematically examined. This paper investigates the NO mechanism in the syngas MILD regime under the dilution of N₂, CO₂, and H₂O through counterflow combustion simulation. The syngas reaction mechanism and the counterflow combustion simulation are comprehensively validated under different CO/H₂ ratios and strain rates. The effects of oxygen volume fraction, CO/H₂ ratio, pressure, strain rate, and dilution atmosphere are systematically investigated. For all the MILD cases, the contribution of the prompt and NO-reburning routes to the overall NO emission is less than 0.1% due to the lack of CH₄ in fuel. At atmospheric pressure, the thermal route only accounts for less than 20% of the total NO emission because of the low reaction temperature. Moreover, at atmospheric pressure, the contribution of the NNH route to NO emission is always larger than 55% in the N₂ atmosphere. The N₂O-intermediate route is enhanced in CO₂ and H₂O atmospheres due to the increased third-body effects of CO₂ and H₂O through the reaction N₂ + O (+M) ? N₂O (+M). Especially in the H₂O atmosphere, the N₂O-intermediate route contributes to 60% NO at most. NO production is reduced with increasing CO/H₂ ratio or pressure, mainly due to decreased NO formation from the NNH route. Importantly, a high reaction temperature and low NO emission are simultaneously achieved at high pressure. To minimize NO emission, the reactions should be operated at high values of CO/H₂ ratios (i.e., >4) and pressures (e.g., P > 10 atm), low oxygen volume fractions (e.g., X_O2 < 15%), and using H₂O as a diluent. This study provides a new fundamental understanding of the NO mechanism of syngas MILD combustion in N₂, CO₂, and H₂O atmospheres.