NOx formation chemical kinetics in IC engines

2022 ◽  
pp. 39-68
Author(s):  
Avinash Alagumalai ◽  
Amin Jodat ◽  
Omid Mahian ◽  
B. Ashok
Author(s):  
Stefano d’Ambrosio ◽  
Ezio Spessa ◽  
Alberto Vassallo

New computational procedures are proposed for evaluating the exhaust brake specific mass emissions of each pollutant species in IC engines. The procedures start from the chemical reaction of fuel with combustion air and, basing on the measured exhaust raw emissions THC, CH4, NOx, CO, O2, CO2, calculate the volume fractions of the compounds in the exhaust gases, including those that are not usually measured, such as water, nitrogen and hydrogen. The method also takes the effects of various fuel and combustion air compositions into account, with particular reference to different natural gas blends as well as to the presence of water vapor, CO2, Ar and He in the combustion air. The molecular mass of the exhaust gases is then evaluated and the brake specific emissions can be obtained if the exhaust flow rate and the engine power output are measured. The methods stem from the extension of the different procedures that are used in the literature to evaluate α from measured raw volume emissions of IC engines running on conventional fuels. In the present study, a new algorithm is developed so as to generalize and refine all the mentioned α evaluation procedures, keeping conventional and alternative fuel compositions into account. First, the algorithm is applied to the evaluation of α in an automotive bi-fuel SI engine running on gasoline and CNG under a wide range of operating conditions. The α evaluation tests were carried out with a carefully controlled multipoint sequential injection system for both gasoline and CNG fueling. The results are compared to those obtained from the directly measured air and fuel mass flow rates as well as from more conventional UEGO sensor data. The algorithm is then applied to the evaluation of the brake specific mass emission of each pollutant species under gasoline and CNG engine operations for different steady-state working conditions. The sensitivity of results to the main engine working parameters, the influence of environmental conditions (in particular the effect of air humidity on NOx formation) and the experimental uncertainties are determined. The specific emissions calculated from the proposed algorithm are finally compared to those obtained by applying SAE and ISO recommended practices.


2018 ◽  
Vol 19 (3) ◽  
pp. 1-14 ◽  
Author(s):  
Elena V. Kustova ◽  
◽  
Aleksei S. Savelev ◽  
Anastasia A. Lukasheva ◽  
◽  
...  

Author(s):  
B. S. Soroka

The article considers the role and place of water and water vapor in combustion processes with the purpose of reduction the effluents of nitrogen oxides and carbon oxide. We have carried out the complex of theoretical and computational researches on reduction of harmful nitrogen and carbon oxides by gas fuel combustion in dependence on humidity of atmospheric air by two approaches: CFD modeling with attraction of DRM 19 chemical kinetics mechanism of combustion for 19 components along with Bowman’s mechanism used as “postprocessor” to determine the [NO] concentration; different thermodynamic models of predicting the nitrogen oxides NO formation. The numerical simulation of the transport processes for momentum, mass and heat being solved simultaneously in the united equations’ system with the chemical kinetics equations in frame of GRI methane combustion mechanism and NO formation calculated afterwards as “postprocessor” allow calculating the absolute actual [CO] and [NO] concentrations in dependence on combustion operative conditions and on design of furnace facilities. Prediction in frame of thermodynamic equilibrium state for combustion products ensures only evaluation of the relative value of [NO] concentration by wet combustion the gas with humid air regarding that in case of dry air – oxidant. We have developed the methodology and have revealed the results of numerical simulation of impact of the relative humidity of atmospheric air on harmful gases formation. Range of relative air humidity under calculations of atmospheric air under impact on [NO] and [CO] concentrations at the furnace chamber exit makes φ = 0 – 100%. The results of CFD modeling have been verified both by author’s experimental data and due comparing with the trends stated in world literature. We have carried out the complex of the experimental investigations regarding atmospheric air humidification impact on flame structure and environmental characteristics at natural gas combustion with premixed flame formation in open air. The article also proposes the methodology for evaluation of the nitrogen oxides formation in dependence on moisture content of burning mixture. The results of measurements have been used for verification the calculation data. Coincidence of relative change the NO (NOx) yield due humidification the combustion air revealed by means of CFD prediction has confirmed the qualitative and the quantitative correspondence of physical and chemical kinetics mechanisms and the CFD modeling procedures with the processes to be studied. A sharp, more than an order of reduction in NO emissions and simultaneously approximately a two-fold decrease in the CO concentration during combustion of the methane-air mixture under conditions of humidification of the combustion air to a saturation state at a temperature of 325 K.


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