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To meet stringent emissions regulations, filtration devices are often used in engine exhaust systems to reduce particulate mass (PM) and particulate number (PN). Diesel particulate filters (DPFs) are a well-established means of reducing PM from diesel engines to meet emissions regulations. New emissions regulations will most likely require a similar technology on gasoline engines with direct injection, gasoline particulate filters (GPFs). Due to differences in the exhaust and particulate characteristics, the design and operation of GPFs and DPFs differ. In a DPF filtration is dominated by the buildup of a soot cake. Whereas in a GPF, much of the soot is trapped inside the porous substrate, or filter wall, where deep-bed filtration is dominant. Thus, an accurate model describing the porous filtration properties of GPF substrates is desired. The pore filtration model (PFM) was developed to more accurately model the deep-bed filtration process that occurs in a GPF.

Modeling ignition kernel development in spark ignition engines is crucial to capturing the sources of cyclic variability, both with RANS and LES simulations. Appropriate kernel modeling must ensure that energy transfer from the electrodes to the gas phase has the correct timing, rate and locations, until the flame surface is large enough to be represented on the mesh by the G-Equation level-set method. However, in most kernel models, geometric details driving kernel growth are missing: either because it is described as Lagrangian particles, or because its development is simplified, i.e., down to multiple spherical flames. This paper covers the geometric aspects of kernel development, which makes up the core of a Triangulated Lagrangian Ignition Kernel model. One (or multiple, if it restrikes) spark channel is initialized as a one-dimensional Lagrangian particle thread.

A novel 2-zone combustion chamber concept (patent pending) was developed using multi-dimensional modeling. At minimum volume, an axial projection in the piston divides the volume into distinct zones joined by a communication channel. The projection provides a means to control the mixture formation and combustion phasing within each zone. The novel combustion system was applied to reactivity controlled compression ignition (RCCI) combustion in both light-duty and heavy-duty diesel engines. Results from the study of an 8.8 bar BMEP, 2600 RPM operating condition are presented for the light-duty engine. The results from the heavy-duty engine are at an 18.1 bar BMEP, 1200 RPM operating condition. The effect of several major design features were investigated including the volume split between the inner and outer combustion chamber volumes, the clearance (squish) height, and the top ring land (crevice) volume.

While Low Temperature Combustion (LTC) strategies such as Reactivity Controlled Compression Ignition (RCCI) exhibit high thermal efficiency and produce low NOx and soot emissions, low load operation is still a significant challenge due to high unburnt hydrocarbon (UHC) and carbon monoxide (CO) emissions, which occur as a result of poor combustion efficiencies at these operating points. Furthermore, the exhaust gas temperatures are insufficient to light-off the Diesel Oxidation Catalyst (DOC), thereby resulting in poor UHC and CO conversion efficiencies by the aftertreatment system. To achieve exhaust gas temperature values sufficient for DOC light-off, combustion can be appropriately phased by changing the ratio of gasoline to diesel in the cylinder, or by burning additional fuel injected during the expansion stroke through post-injection.

The SCR Filter simultaneously reduces NOx and Particle Matter (PM) in the exhaust and is considered an effective way to meet emission regulations. By combining the function of a Diesel Particulate Filtration (DPF) and a Selective Catalytic Reduction (SCR), the SCR Filter reduces the complexity and cost of aftertreatment systems in diesel vehicles. Moreover, it provides an effective reaction surface and potentially reduces backpressure by combining two devices into one. However, unlike traditional flow through type SCR, the deNOx reactions in the SCR Filter can be affected by the particulate filtration and regeneration process. Additionally, soot oxidation can be affected by the deNOx process. A 1-D kinetic model for integrated DPF and NH3-SCR system over Cu-zeolite catalysts was developed and validated with experimental data in previous work[1].

Homogeneous low temperature combustion is believed to be a promising approach to resolve the conflict of goals between high efficiency and low exhaust emissions. Disadvantageously for this kind of combustion, the whole process depends on chemical kinetics and thus is hard to control. Reactivity controlled combustion can help to overcome this difficulty. In the so-called RCCI (reactivity controlled compression ignition) combustion concept a small amount of pilot diesel that is injected directly into the combustion chamber ignites a highly diluted gasoline-air mixture. As the gasoline does not ignite without the diesel, the pilot injection timing and the ratio between diesel and gasoline can be used to control the combustion process. A phenomenological multi-zone model to predict RCCI combustion has been developed and validated against experimental and 3D-CFD data. The model captures the main physics governing ignition and combustion.

A Three-Way Catalyst (TWC) model with global TWC kinetics for lean burn DISI engines were developed and validated. The model incorporates kinetics of hydrocarbons and carbon monoxide oxidations, NOx reduction, water-gas and steam reforming and oxygen storage. Ammonia (NH₃) and new nitrous oxide (N₂O) kinetics were added into the model to study NH₃ and N₂O formation in TWC systems. The model was validated over a wide range of engine operating conditions using various types of experimental data from a lean burn automotive SIDI engine. First, well-controlled time-resolved steady state data were used for calibration and initial model tests. In these steady state operations, the engine was switched between lean and rich conditions for NOx emission control. Then, the model was further validated using a large set of time-averaged steady state data. Temperature dependencies of NH₃ and N₂O kinetics in the TWC model were examined and well captured by the model.

A fundamentally based quasi-dimensional NOx emission model for spark ignition direct injection (SIDI) gasoline engines was developed. The NOx model consists of a chemical mechanism and three sub-models. The classical extended Zeldovich mechanism and N₂O pathway for NOx formation mechanism were employed as the chemical mechanism in the model. A characteristic time model for the radical species H, O and OH was incorporated to account for non-equilibrium of radical species during combustion. A model of homogeneity which correlates fundamental dimensionless numbers and mixing time was developed to model the air-fuel mixing and inhomogeneity of the charge. Since temperature has a dominant effect on NOx emission, a flame temperature correlation was developed to model the flame temperature during the combustion for NOx calculation. Measured NOx emission data from a single-cylinder SIDI research engine at different operating conditions was used to validate the NOx model.

DPF regenerations involve a trade-off between fuel economy and DPF durability. High temperature regenerations of DPFs have fewer fuel penalties but simultaneously tend to give higher substrate temperatures, which can reduce thermal reliability. In order to weaken the trade-off, the integrated system-level model [1,2,3,4] is used to conduct optimization studies and explore novel regeneration strategies for DPF aftertreatment devices. The integrated model developed in the Engine Research Center (ERC) includes sub-models for engines, emissions, aftertreatment devices and controllers. Based on the engine and regeneration fuel economy, multiple and single cycle regeneration tests are performed and analyzed. The optimal soot loadings to initiate and terminate regenerations are discussed. A pulsed regeneration strategy, which is characterized by injecting multiple pulses of fuel (upstream of a DOC) during regenerations, is investigated.

Diesel particulate samples were collected from a light duty engine operated at a single speed-load point with a range of biodiesel and conventional fuel blends. The oxidation reactivity of the samples was characterized in a laboratory reactor, and BET surface area measurements were made at several points during oxidation of the fixed carbon component of both types of particulate. The fixed carbon component of biodiesel particulate has a significantly higher surface area for the initial stages of oxidation, but the surface areas for the two particulates become similar as fixed carbon oxidation proceeds beyond 40%. When fixed carbon oxidation rates are normalized to total surface area, it is possible to describe the oxidation rates of the fixed carbon portion of both types of particulates with a single set of Arrhenius parameters. The measured surface area evolution during particle oxidation was found to be inconsistent with shrinking sphere oxidation.

System-level models containing engine model, emission models, and aftertreatment device models have been developed. All the sub-models have been developed separately and come from a variety of different sources. A new phenomenological CO model recently has been coupled into the previous integrated model. The emission models, including PM (particulate matter), NOx, and CO are also calibrated from experimental data. Some modification has been added to improve the integrated model and accept different aftertreatment device models for future work. The objective of this work is to study the DPF (Diesel Particulate Filter) regeneration during transient operating conditions using the integrated model. The integrated system-level model is used to studying the dynamic performance between engine and aftertreatment system. In this study, the calibrated emission models are validated at transient operating conditions.

This work integrated a CA10 (crank angle at 10% heat release) controller into an integrated engine, emissions and aftertreatment model platform. Two CA10 phasing targets were chosen to analyze how advancing (or retarding) the target combustion phasing (CA10) affect the formation of NO and CO. The effect of intake valve closure (IVC) timing, which is the control mechanism for maintaining the target combustion phasing, on the cylinder trapped mass, and hence the charge temperature after compression is detailed. Finally, the relation between combustion phasing and the blow-down process leading to the exhaust process is discussed. Retarding the target combustion phasing by two degrees saw a 330 K drop in compressed charge temperature and a quadrupled reduction of peak NO emitted. Peak NO₂ emission reduced three times on account of the same. However, an increase in CO emission was observed when the combustion phasing was advanced.

This article presents nondestructive neutron computed tomography (nCT) measurements of Diesel Particulate Filters (DPFs) as a method to measure ash and soot loading in the filters. Uncatalyzed and unwashcoated 200cpsi cordierite DPFs exposed to 100% biodiesel (B100) exhaust and conventional ultra low sulfur 2007 certification diesel (ULSD) exhaust at one speed-load point (1500 rpm, 2.6 bar BMEP) are compared to a brand new (never exposed) filter. Precise structural information about the substrate as well as an attempt to quantify soot and ash loading in the channel of the DPF illustrates the potential strength of the neutron imaging technique.

Two different types of mesh used for diesel combustion with the KIVA-4 code are compared. One is a well established conventional KIVA-3 type polar mesh. The other is a non-polar mesh with uniform size throughout the piston bowl so as to reduce the number of cells and to improve the quality of the cell shapes around the cylinder axis which can contain many fuel droplets that affect prediction accuracy and the computational time. This mesh is specialized for the KIVA-4 code which employs an unstructured mesh. To prevent dramatic changes in spray penetration caused by the difference in cell size between the two types of mesh, a recently developed spray model which reduces mesh dependency of the droplet behavior has been implemented. For the ignition and combustion models, the Shell model and characteristic time combustion (CTC) model are employed.

A kinetic carbon monoxide (CO) emission model is developed to simulate engine out CO emissions for conventional diesel combustion. The model also incorporates physics governing CO emissions for low temperature combustion (LTC). The emission model will be used in an integrated system level model to simulate the operation and interaction of conventional and low temperature diesel combustion with aftertreatment devices. The Integrated System Model consists of component models for the diesel engine, engine-out emissions (such as NOx and Particulate Matter), and aftertreatment devices (such as DOC and DPF). The addition of CO emissions model will enhance the capability of the Integrated System Model to predict major emission species, especially for low temperature combustion. In this work a CO emission model is developed based on a two-step global kinetic mechanism [8].

An integrated system model containing sub-models for a multi-cylinder diesel engine, NOx and soot(PM) emissions, diesel oxidation catalyst (DOC) and diesel particulate filter (DPF) has been developed to simulate the engine and aftertreatment systems at transient engine operating conditions. The objective of this work is two-fold; ensure correct implementation of the integrated system level model and apply the integrated model to understand the fuel economy trade-off for various DPF regeneration strategies. The current study focuses on a 1.9L turbocharged diesel engine and its exhaust system. The engine model was built in GT-Power and validated against experimental data at full-load conditions. The DPF model is calibrated for the current engine application by matching the clean DPF pressure drop for different mass flow rates. Load, boost pressure, speed and EGR controllers are tuned and linked with the current engine model.

A computational, three-dimensional approach to investigate the behavior of diesel soot particles in the micro-channels of wall-flow Diesel Particulate Filters is presented. The KIVA3V CFD code, already extended to solve the 2D conservation equations for porous media materials [1], has been enhanced to solve in 2-D and 3-D the governing equations for reacting and compressible flows through porous media in non axes-symmetric geometries. With respect to previous work [1], a different mathematical approach has been followed in the implementation of the numerical solver for porous media, in order to achieve a faster convergency as source terms were added to the governing equations. The Darcy pressure drop has been included in the Navier-Stokes equations and the energy equation has been extended to account for the thermal exchange between the gas flow and the porous wall.

An integrated system model containing sub-models for diesel engine, emissions, and aftertreatment devices has been developed. The objective is to study engine-device and device-device interactions. The emissions sub-models used are for NOx and PM (particulate matter) prediction. The aftertreatment sub-models used include a diesel oxidation catalyst (DOC) and a diesel particulate filter (DPF). Controllers have also been developed to allow for transient simulations, active DPF regeneration, and prevention/control of runaway DPF regenerations. The integrated system-level model has been used to simulate DPF regeneration via exhaust fuel injection ahead of the DOC. In addition, the controller model can use intake throttling to assist in active DPF regeneration if needed. Regeneration studies have been done for both steady engine load and with load transients. High to low engine load transients are of particular interest because they can lead to runaway DPF regeneration.

An integrated system model containing sub-models for a diesel engine, NOx and soot emissions, and a diesel particulate filter (DPF) has been used to simulate stead-state engine operating conditions. The simulation results have been used to investigate the effect of DPF loading and passive regeneration on engine performance and emissions. This work is the continuation of previous work done to create an overall diesel engine/exhaust system integrated model. As in the previous work, a diesel engine, exhaust system, engine soot emissions, and diesel particulate filter (DPF) sub-models have been integrated into an overall model using Matlab Simulink. For the current work new sub-models have been added for engine-out NOx emissions and an engine feedback controller. The integrated model is intended for use in simulating the interaction of the engine and exhaust aftertreatment components.

A two dimensional CFD model has been developed to study the mechanism of soot deposition on the porous wall surface in a Diesel Particulate Filter (DPF). The goal is to improve understanding of the soot deposition and its interaction with the hydrodynamic behaviour of the device. The KIVA3V CFD code and pre-processor were modified to simulate a single channel in a DPF. The code was extended to solve the conservation equations in porous media materials, to account for the sticking of particles on a porous surface and to evaluate the increasing resistance to the flow as the soot inside the trap accumulates. The code is already configured to track Lagrangian particles and these were modified to represent the soot particles in the flow. The code pre-processor was modified to allow definition of a double-symmetric geometry and to specify porous cells.