I have found a few calculation prediction models for NOx and Soot(Carbon monoxide CO) formations that are applicable in my research. However, I have not similar models for prediction of emissions after implementation of a three-way catalyst and NOx reduction, all I have found were experimental results. Is there a numerical method to obtain this?

I have attached 2 publications I have obtained from this site which i am using to obtain these values, with the Temperature obtained from the results of a combustion sector simulation of ANSYS Internal Combustion.

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