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The present work introduces an extended particulate filter model focusing on capabilities to cover catalytic and surface storage reactions and to serve as a virtual multi-functional reactor/separator. The model can be classified as a transient, non-isothermal 1D+1D two-channel model. The applied modeling framework offers the required modeling depth to investigate arbitrary catalytic reaction schemes and it follows the computational requirement of running in real-time. The trade-off between model complexity and computational speed is scalable. The model is validated with the help of an analytically solved reference and the model parametrization is demonstrated by simulating experimentally given temperatures of a heat-up measurement. The detailed 1D+1D model is demonstrated in a concept study comparing the impact of different spatial washcoat distributions.

The present work describes an existing transient, non-isothermal 1D+1D particulate filter model to capture the impact of different types of particulate matter (PM) on filtration and regeneration. PM classes of arbitrary characteristics (size, composition etc.) are transported and filtered following standard mechanisms. PM deposit populations of arbitrary composition and contact states are used to describe regeneration on a micro-kinetical level. The transport class and deposit population are linked by introducing a splitting deposit matrix. Filtration and regeneration modes are compared to experimental data from literature and a brief numerical assessment on the filtration model is performed. The filter model as part of an exhaust line is used in a concept study on different coating variants. The same exhaust line model is connected to an engine thermodynamic and vehicle model. This system model is run through a random drive cycle in office simulation.

The present work introduces an innovative mechanistically based 0D spray model which is coupled to a combustion model on the basis of an advanced mixture controlled combustion approach. The model calculates the rate of heat release based on the injection rate profile and the in-cylinder state. The air/fuel distribution in the spray is predicted based on momentum conservation by applying first principles. On the basis of the 2-zone cylinder framework, NOx emissions are calculated by the Zeldovich mechanism. The combustion and emission models are calibrated and validated with a series of dedicated test bed data specifically revealing its capability of describing the impact of variations of EGR, injection timing, and injection pressure. A model based optimization is carried out, aiming at an optimum trade-off between fuel consumption and engine-out emissions. The findings serve to estimate an economic optimum point in the NOx/BSFC trade-off.

Wall flow particulate filters have been used as a standard exhaust aftertreatment device for many years. The interaction of particulate matter (PM) regeneration and catalytically supported reactions strongly depends on the given operating conditions. Temperature, species concentration and mass flow cause a change from advective to diffusive-controlled flow conditions and influence the rate controlling dominance of individual reactions. A transient 1D+1D model is presented considering advective and diffusive transport phenomena. The reaction scheme focuses on passive PM conversion and catalytic oxidation of NO. The model is validated with analytical references. The impact of back-diffusion is explored simulating pure advective and combined advective diffusive species transport. Rate approaches from literature are applied to investigate PM conversion at various operating conditions.

Non-combustible particles, commonly summarized as ash, influence the lifetime performance of wall flow filters. This study aims to investigate this influence by means of simulation. An existing transient 1D+1D wall flow filter model is extended by dedicated transport balances for soot and ash (1), by a discrete cake model describing changing soot and ash compositions over the cake height (2), by a phenomenological cake filtration model (3), by dedicated cake property models (4) and by a phenomenological model capturing the radial mobility of solids within the cake (5). Results of three different types of simulations are shown. First, the various sub-models are assessed in isolated simulation configurations. The combination of these shall serve as theoretical model validation. Second, isolated loading and passive regeneration simulations are performed.