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This paper deals with some recent advances in the field of 1D fluid dynamic modeling of unsteady reacting flows in complex s.i. engine pipe-systems, involving a catalytic converter. In particular, a numerical simulation code has been developed to allow the simulation of chemical reactions occurring in the catalyst, in order to predict the chemical specie concentration in the exhaust gas from the cylinder to the tailpipe outlet, passing through the catalytic converter. The composition of the exhaust gas, discharged by the cylinder and then flowing towards the converter, is calculated by means of a thermodynamic two-zone combustion model, including emission sub-models. The catalytic converter can be simulated by means of a 1D fluid dynamic and chemical approach, considering the laminar flow in each tiny channel of the substrate.

In this work a detailed model to simulate the transient behavior of catalytic converters is presented. The model is able to predict the unsteady and reacting flows in the exhaust ducts, by solving the system of conservation equations of mass, momentum, energy and transport of reacting chemical species. The en-gine and the intake system have not been included in the simulation, imposing the measured values of mass flow, gas temperature and chemical composition as a boundary condition at the inlet of the exhaust system. A detailed analysis of the diffusion stage triggering is proposed along with simplifications of the physics, finalized to the reduction of the calculation time. Submodels for water condensation and its following evaporation on the monolith surface have been taken into account as well as oxygen storage promoted by ceria oxides.

Metallic foams or sponges are materials with a cell structure suitable for many industrial applications, such as reformers, heat catalytic converters, etc. The success of these materials is due to the combination of various characteristics such as mechanical strength, low density, high specific surface, good thermal exchange properties, low flow resistance and sound absorption. Different materials and manufacturing processes produce different type of structure and properties for various applications. In this work a genetic algorithm has been developed and applied to support the design of catalytic devices. In particular, two substrates were considered, namely the traditional honeycomb and an alternative open-cell foam type. CFD simulations of pressure losses and literature based correlations for the heat and mass transfer were used to support the genetic algorithm in finding the best compromise between flow resistance and pollutant abatement.

The paper describes the 1-D fluid dynamic modeling of unsteady flows with chemical specie tracking in the ducts of a four-cylinder s.i. automotive engine, to predict the composition of the exhaust gas reaching the catalyst inlet. A comprehensive simulation model, based on classical and innovative numerical techniques for the solution of the governing equations, has been developed. The non-traditional shock-capturing CE-SE (Conservation Element-Solution Element) method has been extended to deal with the propagation of chemical species. A comparison of the MacCormack method plus FCT or TVD algorithms with the CE-SE method has pointed out the superiority of the latter scheme in the propagation of contact discontinuities. A realistic composition of the exhaust products in the cylinder, evaluated by a two-zone combustion model including emission sub-models, has been imposed at the opening of the exhaust valve, considering the effect of short-circuit of air during valve overlap.

The transient heat transfer behavior of an automotive catalytic converter has been simulated with OpenFOAM in 1D. The model takes into consideration the gas-solid convective heat transfer, axial wall conduction and heat capacity effects in the solid phase, but also the chemical reactions of CO oxidation, based on simplified Arrhenius and Langmuir-Hinshelwood approaches. The associated parameters are the results of data in literature tuned by experiments. Simplified cases of constant flow rates and gas temperatures in the catalyst inflow have been chosen for a comprehensive analysis of the heat and mass transfer phenomena. The impact of inlet flow temperatures and inlet flow rates on the heat up characteristics as well as in the CO emissions have been quantified. A dimensional analysis is proposed and dimensionless temperature difference and space-time coordinates are introduced.

In order to fulfill the more and more stringent emission levels (Euro V, SULEV…), catalytic converter light-off time has to be reduced as much as possible. Consequently, all the parts upstream of the catalytic converter have to be designed in order to minimize the gas heat loss. As a matter of fact, considering the emission performance, all components of the hot end contribute to a better after-treatment. In this study, we focus on the exhaust manifold, that has a major contribution to the thermal mass upstream of the catalyst. The study carried out aims at highlighting the impact of fabricated manifold length and thickness on emissions and engine performance. Several manifold designs, dedicated to different naturally aspirated gasoline engine applications, have been tested on a dynamic engine bench or chassis dyno. Emission results were also supported by temperature measurements.

The paper describes the research work concerning the simulation of 1D unsteady reacting flows in s.i. engine pipe-systems, including pre-catalysts and main catalysts. The numerical model GASDYN has been developed to enable the concurrent prediction of the wave motion in the intake and exhaust ducts, the chemical composition of the gas discharged by the cylinder of a s.i. engine, the chemical and thermal behavior of catalytic converters. The effect of considering the transport of chemical species with reactions in gas phase (post-oxidation of unburned HC in the exhaust manifold) and in solid phase (conversion of pollutants in the catalyst) on the predicted wave motion is reported.