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Even though the 3-way catalyst chemistry has been studied extensively in the literature, some performance aspects of practical relevance have not been fully explained. It is believed that the Oxygen Storage Capacity function of 3-way catalytic components dominates the behavior during stoichiometry transitions from lean to rich mode and vice versa whereas a number of mathematical models have been proposed to describe the dynamics of pollutant conversion. Previous studies have suggested a strong impact of Sulfur on the pollutant conversion after a lean to rich transition, which has not been adequately explained and modelled. Lean to rich transitions are highly relevant to catalyst ‘purging’ needed after exposure to high O2 levels (e.g. after fuel cut-offs). This work presents engine test measurements with an engine-aged catalyst that highlight the negative impact of Sulfur on pollutant conversion after a lean to rich transition.

A Euro6 gasoline light duty vehicle has been tested at the engine dynamometer and the emissions have been analyzed upstream and downstream the Three-Way-Catalyst (TWC) during a WLTC cycle. Catalyst simulations have been used for assessing the processes inside the catalytic converter using a reaction scheme based on 19 brutto reactions (direct oxidation and reduction, selective catalytic reductions with CO, C3H6 and H2, steam reforming, water-gas shift and bulk ceria as well as surface ceria reactions). The reactions have been parameterized in order to best approximate the measurements. Based on the reactions taken into account, the real vehicle emissions can be predicted with good accuracy. The simulations show that the cycle emissions comprise mainly the cold start contribution as well as discrete emission break-through events during transients. During cold start no reactions are evident in the catalyst before the temperature of the gas entering the catalyst reaches 270°C.

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.

Particulate filters are a widely used emission control device on heavy-duty diesel engines. The accumulation of particulate matter, mostly consisting of soot, inside the filter results in increased filter pressure-drop (backpressure). This increased backpressure has been used by the on-board control systems as trigger for regeneration procedures, which aim to actively oxidize the accumulated soot. However, it is known that passive soot oxidation during normal operation affects the correlation between backpressure and the deposited soot mass in filter. Therefore, the backpressure alone cannot be a reliable trigger for regeneration. In this work we highlight operating conditions with very poor correlation between backpressure and accumulated soot mass in filter and evaluate the possible root causes. Experiments with several heavy-duty diesel engines and particulate filters were conducted on engine test bench.

The paper describes the development of a modelling approach to simulate the effect of the new Worldwide harmonized Light duty Test Procedure (WLTP) on the certified CO2 emissions of light duty vehicles. The European fleet has been divided into a number of segments based on specific vehicle characteristics and technologies. Representative vehicles for each segment were selected. A test protocol has been developed in order to generate the necessary data for the validation of the vehicle simulation models. In order to minimize the sources of uncertainty and the effects of flexibilities, a reference “template model” was developed to be used in the study. Subsequently, vehicle models were developed using AVL Cruise simulation software based on the above mentioned template model. The various components and sub-modules of the models, as well as their input parameters, have been defined with the support of the respective OEMs.

The pressure for compact and efficient deNO systems has led to increased interest of incorporating SCR coatings in the DPF walls. This technology could be very attractive especially if high amounts of washcoat loadings could be impregnated in the DPF porous walls, which is only possible with high porosity filters. To counterbalance the filtration and backpressure drawbacks from such high porosity applications, the layered wall technology has already been proposed towards minimizing soot penetration in the wall and maximizing filtration efficiency. In order to deal with the understanding of the complex interactions in such advanced systems and assist their design optimization, this paper presents an advanced modeling framework and selected results from simulation studies trying to illustrate the governing phenomena affecting deNO performance and passive DPF regeneration in the above combined systems.

The development of thermally durable zeolite NH3/Urea-SCR formulations coupled with that of high porosity filters substrates has opened the way to integrate PM and NOx control into a single device, namely an SCR-coated Diesel Particulate Filter (SCRF). A few experimental works are already present in the literature regarding SCRF systems, mainly addressing the DeNOx performances of the system (in both presence and absence of soot) under both steady state and transient conditions. The purpose of the present work is to perform a simulation study focused on phenomena which are expected to play key roles in SCRF systems, such as coupling of reaction and diffusion phenomena, soot effect on DeNOx activity, SCR coating effect on soot regeneration and filtration efficiency and competition between soot oxidation and DeNOx processes involving NO2.

Reducing fuel consumption and emissions from road transport is a key factor for tackling global warming, promoting energy security and sustaining a clean environment. Several technical measures have been proposed in this aspect amongst which the application of low viscosity engine lubricants. Low viscosity lubricants are considered to be an interesting option for reducing fuel consumption (and CO2 emissions) throughout the fleet in a relatively cost effective way. However limited data are available regarding their actual “real-world” performance with respect to CO2 and other pollutant emissions. This study attempts to address the issue and to provide experimental data regarding the benefit of low viscosity lubricants on fuel consumption and CO2 emissions over both the type-approval and more realistic driving cycles.

This study examines the effects of neat soy-based biodiesel (B100) and its 50% v/v blend (B50) with low sulphur automotive diesel on vehicle PAH emissions. The measurements were conducted on a chassis dynamometer with constant volume sampling (CVS) according to the European regulated technique. The vehicle was a Euro 2 compliant diesel passenger car, equipped with a 1.9 litre common-rail turbocharged direct injection engine and an oxidation catalyst. Emissions of PAHs, nitro-PAHs and oxy-PAHs were measured over the urban phase (UDC) and the extra-urban phase (EUDC) of the type approval cycle (NEDC). In addition, for evaluating realistic driving performance the non-legislated Artemis driving cycles (Urban, Road and Motorway) were used. Overall, 12 PAHs, 4 nitro-PAHs, and 6 oxy-PAHs were determined. The results indicated that PAH emissions exhibited a reduction with biodiesel during all driving modes.

As the Diesel Particulate Filter (DPF) technology is nowadays established, research is currently focusing on meeting the emission and durability requirements by proper system design. This paper focuses on the optimum combination between the catalytic coating and substrate structural properties using experimental and simulation methodologies. The application of these methodologies will be illustrated for the case of SiC substrates coated with innovative sol-gel coatings. Coated samples are characterized versus their uncoated counterparts. Multi-dimensional DOC and DPF simulation models are used to study several effects parametrically and increase our understanding on the governing phenomena. The comparative analysis of DOC/DPF systems covers filtration – pressure drop characteristics, CO/HC/NO oxidation performance, effect of washcoat amount and catalyst dispersion on oxidation activity and finally passive regeneration performance.

Catalyzed wall-flow particulate filters are increasingly applied in diesel exhaust after-treatment for multiple purposes, including low-temperature catalytic regeneration, CO and hydrocarbon conversion, as well as exothermic heat generation during forced regeneration. In order to optimize Precious Metals usage, it may be advantageous to apply the catalytic coating non-uniformly in the DPF, a technology referred to as “catalyst zoning”. In order to simulate the behavior of such a filter, one has to consider coupled transport-reaction modeling. In this work, a previously developed model is calibrated versus experimental data obtained with full-scale catalyzed filters on the engine dynamometer. In a next step, the model is validated under a variety of operating conditions using engine experiments with zoned filters. The performance of the zoned catalyst is analyzed by examining the transient temperature and species profiles in the inlet and outlet channels.

An alternative metal foam substrate for exhaust aftertreatment applications has been recently presented and characterized. The present paper focuses on the potential of the metal foam technology as an efficient DOC and CDPF substrates on real-world conditions. The target platform is a mid-size passenger car and the methodology includes both modeling and experiments. The experimental testing starts from small-scale reactor characterization of the basic heat/mass transfer properties and chemical kinetics. The results show that the foam structure exhibits excellent mass-transport properties offering possibilities for precious metal and catalyst volume savings for oxidation catalyst applications. These results are also used to calibrate an advanced 2-dimensional model which is able to predict the transient filtration and reaction phenomena in axial and radial flow systems.

The design of integrated exhaust lines that combine particulate and NOx emission control is a multidimensional optimization problem. The present paper demonstrates the use of an exhaust system simulation platform which is composed of well-established multidimensional mathematical models for the transient thermal and chemical phenomena in DOC, DPF and SCR systems as well as connecting pipe heat transfer effects. The analysis is focused on the European Driving Cycle conditions. Illustrative examples on complete driving cycle simulations with and without forced regeneration events are presented for alternative design approaches. The results illustrate the importance of DOC and DPF heat capacity effects and connecting pipe heat losses on the SCR performance. The possibility of combining DPF and SCR functionality on a single wall-flow substrate is studied.

A new metal foam material for diesel particulate filtration, trademarked as INCOFOAM® HighTemp, was recently presented. Extensive tests showed the potential of achieving filtration efficiencies of the order of 85% or more at low pressure drop using a radial flow design concept with graded foam porosity. By applying a catalytic washcoat, the foam exhibits enhanced gas mixing and thus higher conversion efficiencies at high space velocities. In addition, due to an excellent soot-catalyst contact, the washcoated foam exhibited high catalytic regeneration rates. The present paper focuses on a novel “cross-flow” design concept for a better filtration/pressure drop trade-off as well as application of the foam as an oxidation catalyst substrate. The experimental testing starts from small-scale reactors and proceeds to real exhaust testing on the engine bench as well as vehicle tests on the chassis dynamometer and on-road testing.

The objective of this study is to present a particulate filter concept, based on a new porous material: INCOFOAM® HighTemp, a Ni-based superalloy foam. The paper examines the filtration and pressure drop characteristics as well as the regeneration performance of different filter configurations, based on experimental data and modeling. A number of different foam structures with variable pore characteristics are studied. The experimental testing covers flow and pressure drop behavior with air and exhaust gas, filtration efficiency measurements as function of particle size and regeneration rate measurements. The testing starts from mini-scale reactors and proceeds to real exhaust testing on the engine bench as well as vehicle tests on the chassis dynamometer and on-road. In parallel, a previously developed mathematical model is applied to study and understand the filtration and pressure drop mechanisms in the case of clean and soot loaded filters.

This paper presents a mathematical model for the simulation of NOx traps during the storage and the regeneration phases. The objective is to validate the model under realistic exhaust gas conditions during NOx storage and release phases. The model is based on a previous modeling platform developed by Aristotle University which simulates the behavior of 3-way catalysts. The previous model is extended to include the additional reactions taking place on a NOx trap, with particular emphasis on the calculation of thermodynamic equilibrium effects. Moreover, the model includes the necessary reactions to simulate catalyst sulfation and de-sulfation processes. In parallel, a set of measurements are conducted under well controlled conditions with real diesel exhaust to study the storage and release phenomena under various operating conditions. The experimental data are used to calibrate the reaction kinetics and validate the model.

Computer Aided Engineering (CAE) Methodologies are increasingly being applied to assist the design of SI-engine exhaust aftertreatment systems, in view of the stage III and IV emissions standards. Following this trend, the design of diesel exhaust aftertreatment systems is receiving more attention in view of the capabilities of recently developed mathematical models. The design of diesel exhaust systems must cope with three major aftertreatment categories: (i) diesel oxidation catalysts, (ii) diesel particulate filters and (iii) de-NOx catalytic converters. An integrated CAE methodology that could assist the design of all these classes of systems is described in this paper.

The design of a diesel particulate trap system to fit a specific vehicular application requires significant expenditure, due to the high degree of interaction between the vehicle operation and trap behavior. The assistance of modeling in the design process is already well established. This paper presents the basic principles of a Computer Aided Engineering methodology aimed to assist the selection of the basic parameters of a Diesel Particulate Trap System by reducing the number of the necessary experimental tests. The computational modules currently supporting the CAE methodology are based on fundamental mathematical models, incorporating a small number of semi-empirical relations derived by experimental data on trap loading and catalytic regeneration, exhaust system heat transfer and trap backpressure effect on fuel consumption.

In view of recent and future US and european regulations the design optimization of 3-way catalytic converters (3WCC) should also account for catalyst durability. The purpose of this paper is to extend the authors' approach for 3WCC modeling and evaluation in the direction of covering some aspects of ageing behavior. After a brief examination of the commonly accepted ageing mechanisms, a new methodology for the assessment of catalyst durability is formulated. This methodology takes into account the effect of thermal loading, high-temperature oxidation and poisoning of the catalyst. Based on the approach presented, along with the 3WCC and other related models and computer codes already in-use by the authors, a comparative assesment of engine bench ageing cycles may be computationally supported. Correlation of vehicle ageing cycles with engine bench cycles may also be accomplished as illustrated by a case study.

The modeling of transient phenomena occurring inside an automotive 3-way catalytic converter poses a significant challenge to the emissions control engineer. Since the significant progress that has been observed with steady-state models cannot be directly exploited in this direction, it is necessary to develop a fully transient model and computer code incorporating dynamic behaviour of the three way catalytic converter in a relatively simple and effective way. The Laboratory of Applied Thermodynamics (LAT), Aristotle University Thessaloniki, is cooperating with the Engine Direction of FIAT Research Center, in the development of a computer code fulfilling these objectives, within the framework of an EEC Brite EuRam cost shared project. The CRF and LAT modeling approaches, along with the underlying philosophy and experimental work, are presented in this paper.