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Parameter tuning was performed against data from a full scale engine rig with a Diesel Oxidation Catalysts (DOC). Several different catalyst configurations were used with varying Pt loading, washcoat thickness and volume. To illustrate the interplay between kinetics and mass transport, engine operating points were chosen with a wide variation in variables (inlet conditions) and both transient and stationary operation was used. A catalyst model was developed where the catalyst washcoat was discretized as tanks in series both radially and axially. Three different model configurations were used for parameter tuning, evaluating three different approaches to modeling of internal transport resistance. It was concluded that for a catalyst model with internal transport resistance the best fit could be achieved if some parameters affecting the internal mass transport were tuned in addition to the kinetic parameters.

A one-dimensional numerical model for a Cu-zeolite SCR catalyst has been developed. The model is based on kinetics developed from laboratory microreactor data for the various NH₃-NOX reactions, as well as for NH₃ oxidation. The kinetic scheme used is discussed and evidence for it presented. The model is capable of predicting the conversion of NO and NO₂, NH₃ slip and the formation of N₂O, as well as effects associated with NH₃ storage and desorption. To obtain a good prediction of catalyst temperature during cold start tests, it was found necessary to include storage and desorption of H₂O in the model; storage of H₂O is associated with a sizable exotherm and the subsequent desorption of this water produces a correspondingly large endotherm.

In recent years, ammonia slip catalysts (ASC) are being used downstream of an SCR system to minimize the ammonia slip. The dual-layer ASC is more attractive for its bi-functionality in reducing the ammonia and NOX emissions. It consists of two layers with the upper layer comprising a component with SCR functionality and the lower layer a PGM containing catalyst with oxidation functionality. Thus, both oxidation and SCR reactions take place in two different layers and are interlinked by the inter-layer mass transfer mechanism. In addition, adsorption and desorption kinetics between the gas and solid phases play a significant role. Mathematically, the overall system is a complex system of mass, momentum and energy transfer equations with temporal and spatial variables in both axial and radial directions. In this work, we focus on devising a suitable, computationally inexpensive model for such ASCs to be efficiently used for design, control and system optimization studies.

This paper will review several different emission control systems for heavy duty diesel (HDD) applications aimed at future legislations. The focus will be on the (DOC+CSF+SCR+ASC) configuration. As of today, various SCR technologies are used on commercial vehicles around the globe. Moving beyond EuroVI/US10 emission levels, both fuel consumption savings and higher catalyst system efficiency are required. Therefore, significant system optimization has to be considered. Examples of this include: catalyst development, optimized thermal management, advanced urea dosing calibrations, and optimized SCR inlet NO:NO2 ratios. The aim of this paper is to provide a thorough system screening using a range of advanced SCR technologies, where the pros and cons from a system perspective will be discussed. Further optimization of selected systems will also be reviewed. The results suggest that current legislation requirements can be met for all SCR catalysts under investigation.