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The NO reduction in an ammonia SCR converter has been simulated by a 1D+1D model for a single representative channel to parametrically study the characteristics of the system under typical operating conditions. An appropriate model has been selected interpreting the chemical behavior of the system and the parameters are calibrated based on a comprehensive set of experiments with an Fe-Zeolite washcoated monolith for different feed concentrations, temperatures and flow rates. Physical and chemical properties are determined as well as kinetics and rate parameters and the model has been verified by experimental data at different operating conditions. Three different mechanisms for the surface kinetics to model NO reduction have been assessed and the results have been compared in the cases of steady DeNO performance and transient response of the system. Ammonia inhibition is considered in the model since it has a major effect specifically under transient operating conditions.

In this study, numerical simulations of in-cylinder processes associated to fuel post-injection in a diesel engine operated at Low Temperature Combustion (LTC) have been performed. An extended Conditional Moment Closure (CMC) model capable of accounting for an arbitrary number of subsequent injections has been employed: instead of a three-feed system, the problem has been described as a sequential two-feed system, using the total mixture fraction as the conditioning scalar. A reduced n-heptane chemical mechanism coupled with a two-equation soot model is employed. Numerical results have been validated with measurements from the optically accessible heavy-duty diesel engine installed at Sandia National Laboratories by comparing apparent heat release rate (AHRR) and in-cylinder soot mass evolutions for three different start of main injection, and a wide range of post injection dwell times.

Optical soot pyrometry is a mature experimental technique that has been applied to a broad range of combustion systems for measuring soot temperature and concentration. Even though the method is widely used and well documented, the line of sight nature of the technique makes the interpretation of its results challenging. Notably, gradients in temperature and soot concentration along the line of sight or across the field of view can introduce significant levels of uncertainty in the results. This paper presents a numerical study where the signal from the experimental two-color pyrometry technique in a marine diesel engine reference experiment is reconstructed employing computational fluid dynamics (CFD) and a detailed Line-by-Line (LBL) spectral radiation model. The analysis is aimed at qualitatively supporting interpretability of experimental observations.

A new approach within the well-known trade-off in combustion process simulations between computational efforts (and thus the capability for engine operating map calculations) on the one hand, and accuracy of predictions on the other, has been developed and applied successfully to diesel combustion, in particular to energy release and pollutant formation. Using phenomenological models in combination with bio-inspired algorithms (for parameter identification), it is now possible to predict thermal, chemical and injection related engine characteristics over an entire operating map including different types of fuel (e.g. diesel, water-in-diesel emulsions and oxygenated diesel).

In this work, numerical simulations of an automotive-sized scavenged pre-chamber mounted in an optically-accessible rapid compression-expansion machine (RCEM) have been carried out using two different turbulence models: Reynolds-Averaged Navier-Stokes (RANS) and Large-Eddy Simulation (LES). The RANS approach is combined with the G-equation combustion model, whereas the LES approach is coupled with the flamelet generated manifold (FGM) model for partially-premixed combustion. Simulation results are compared with experimental data in terms of OH* chemiluminescence in the main chamber. Both RANS and LES results were found to qualitatively reproduce the main features observed experimentally in terms of spatial flame development. Simulation results are further analysed by means of early flame propagation within the pre-chamber (related to the fuel and turbulence intensity distributions) and the ignition process in the main chamber.

Formation of soot in an auto-igniting n-dodecane spray under diesel engine relevant conditions has been investigated numerically. As opposed to research addressing turbulence-chemistry interaction (TCI) by coupling diffusive turbulence models with more sophisticated models in the context of Reynolds-Averaged Navier-Stokes equations (RANS), this study employs the advanced sub-grid scale k-equation model in the framework of a Large Eddy Simulation (LES) together with the uninvolved Direct Integration (DI) approach. A reduced n-heptane chemical mechanism has been employed and artificially accelerated in order to predict the ignition for n-dodecane accurately. Soot processes have been modelled with an extended version of the semi-empirical, two-equation model of Leung, which considers C2H2 as the soot precursor and accounts for particle inception, surface growth by C2H2 addition, oxidation by O2, oxidation by OH and particle coagulation.

In the present work numerical simulations were carried out investigating the effect of fuel type, nozzle-geometry variations and back-pressure changes on high-pressure gas injections under application-relevant conditions. Methane, hydrogen and nitrogen with a total pressure of 500 bar served as high-pressure fuels and were injected into air at rest at 200 bar and 100 bar. Different nozzle shapes were simulated and the analysis of the results lead to a recommendation for the most advantageous geometry regarding jet penetration, volumetric growth, mixing enhancement and discharge coefficient. Additionally an artificial inlet boundary conditions was tested for the use with real-gas thermodynamics and was shown to be capable of reducing the simulation time significantly.

A recently developed auto-ignition model based on a single transport equation in combination with a reduced kinetic scheme has been validated and tested in combination with a cascade jet and droplet breakup model. The validation has been performed by comparing ignition locations and delays for various thermodynamic conditions with experimental data from a high-pressure combustion cell. Also for medium-size diesel engine applications, predictions of ignition delay are in good agreement with experimental observations. In addition, a new approach to the modeling of the early flame development in diesel engine combustion is introduced. The reaction rate in the transition phase from the premixed to the mixing-controlled combustion mode is determined by means of a sub-grid scale model, which describes the evolution of a turbulent diffusion flame. The model has been tested during the early combustion phase of a medium-size, medium-speed DI diesel engine.

This study investigates n-dodecane split injections of “Spray A” from the Engine Combustion Network (ECN) using two different turbulence treatments (RANS and LES) in conjunction with a Conditional Moment Closure combustion model (CMC). The two modeling approaches are first assessed in terms of vapor spray penetration evolutions of non-reacting split injections showing a clearly superior performance of the LES compared to RANS: while the former successfully reproduces the experimental results for both first and second injection events, the slipstream effect in the wake of the first injection jet is not accurately captured by RANS leading to an over-predicted spray tip penetration of the second pulse. In a second step, two reactive operating conditions with the same ambient density were investigated, namely one at a diesel-like condition (900K, 60bar) and one at a lower temperature (750K, 50bar).

Large Eddy Simulations (LES) and tracer-based Laser-Induced Fluorescence (LIF) measurements were performed to study the dynamics of fuel wall-films on the piston top of an optically accessible, four-valve pent-roof GDI research engine for a total of eight operating conditions. Starting from a reference point, the systematic variations include changes in engine speed (600; 1,200 and 2,000 RPM) and load (1000 and 500 mbar intake pressure); concerning the fuel path the Start Of Injection (SOI=360°, 390° and 420° CA after gas exchange TDC) as well as the injection pressure (10, 20 and 35 MPa) were varied. For each condition, 40 experimental images were acquired phase-locked at 10° CA intervals after SOI, showing the wall-film dynamics in terms of spatial extent, thickness and temperature.

Large eddy simulations (LES) of a port-injected 4-valve spark ignited (SI) engine have been carried out with the emphasis on the combustion process. The considered operating point is close to full load at 3,500 RPM and exhibits considerable cyclic variation in terms of the in-cylinder pressure traces, which can be related to fluctuations in the combustion process. In order to characterize these fluctuations, a statistically relevant number of subsequent cycles, namely up to 40, have been computed in the multi-cycle analysis. In contrast to other LES studies of SI engines, here the G-equation (a level set approach) has been adopted to model the premixed combustion in the framework of the STAR-CD/es-ICE flow field solver. Tuning parameters are identified and their impact on the result is addressed.

In this study, the influence of injector diameter on the combustion of diesel sprays in an optically accessible combustion chamber of marine engine dimensions and conditions has been investigated experimentally as well as numerically. Five different orifice diameters ranging between 0.2 and 1.2 mm have been considered at two different ambient temperatures: a “cold” case with 800 K and a “warm” case with 900 K, resulting in a total of ten different test conditions. In the experiment, the reactive spray flames were characterized by means of high-speed OH* chemiluminescence imaging. The measurements revealed a weak impact of the injector diameter on ignition delay (ID) time and flame lift-off length (LOL) whereas the influence of ambient temperature was found to be more pronounced, consistent with former studies in the literature for smaller orifice diameters.

The interaction of turbulent premixed methane combustion with the surrounding flow field can be studied using optically accessible test rigs such as a rapid compression expansion machine (RCEM). The high flexibility offered by such a test rig allows its operation at various thermochemical conditions at ignition. However, limitations inherent to such test rigs due to the absence of an intake stroke do not allow turbulence production as found in IC-engines. Hence, means to introduce turbulence need to be implemented and the relevant turbulence quantities have to be identified in order to enable comparability with engine relevant conditions. A dedicated high-pressure direct injection of air at the beginning of the compression phase is considered as a measure to generate adjustable turbulence intensities at spark timing and during the early flame propagation.

Emissions legislation, fleet CO₂ targets and customer demands are driving the requirements for reducing fuel consumption. This is being achieved in the gasoline market in the near term through the adoption of engine downsizing. In order to reduce fuel consumption further and in the wider real-world operating region complimentary technologies are being investigated and applied to an extreme downsized engine. In this paper future gasoline engine technologies are applied and experimentally assessed in terms of fuel consumption improvement whilst the impact of subsequent loadings on the thermal management system have been simulated, both over drive cycle and using real-world drive data.

The open MAHLE Flexible ECU (MFE) was developed and successfully implemented for controlling gasoline, diesel and hybrid engines. The increased demand of new functions development to address future powertrain challenges, such as lower fuel consumption, ever more stringent emissions legislative targets as well as the need to reduce development time and cost at the same time, led to the incorporation of the MFE functions in a co-simulation environment. The co-simulation environment consists of using the virtual engine developed with 1D or 3D numerical simulation tools and the functions of MFE developed with Simulink-Targetlink. This co-simulation approach allows modifying either the engine control or the engine itself. Regarding the engine control and its development, the existing and new functions were tested for the performance, emissions and behaviour changes on several production and prototype engines.

An existing three-stage ignition delay model which has seen successful application to Primary Reference Fuels (PRFs) has been extended to six surrogate fuels which constitute potential candidates for future Homogeneous Charge Compression Ignition (HCCI) engines. The fuels include petroleum-derived and oxygenated components and can be divided into low, intermediate and high cetane number groups. A new methodology to obtain the model parameters is presented which relies jointly on simulation and experimental data: in a first step, constant volume adiabatic reactor simulations using chemical kinetic mechanisms are performed to generate ignition delays for a very wide range of conditions, namely variations in equivalence ratio, Exhaust Gas Recirculation (EGR), pressure and temperature.

The behavior of spray auto-ignition and combustion of a diesel spray in a lean premixed methane/air charge was investigated. A rapid compression expansion machine with a free-floating piston was employed to reach engine-relevant conditions at start of injection of the micro diesel pilot. The methane content in the lean ambient gas mixture was varied by injecting different amounts of methane directly into the combustion chamber, the ambient equivalence ratio for the methane content ranged from 0.0 (pure air) to 0.65. Two different nozzle tips with three and six orifices were employed. The amount of pilot fuel injected ranged between 0.8 and 1.8 percent of the total energy in the combustion chamber. Filtered OH chemiluminescence images of the combustion were taken with a UV-intensified high-speed camera through the optical access in the piston.

Direct injection of natural gas in engines is considered a promising approach toward reducing engine out emissions and fuel consumption. As a consequence, new gas injection strategies have to be developed for easing direct injection of natural gas and its mixing processes with the surrounding air. In this study, the behavior of a hollow cone gas jet generated by a piezoelectric injector was experimentally investigated by means of tracer-based planar laser-induced fluorescence (PLIF). Pressurized acetone-doped nitrogen was injected in a constant pressure and temperature measurement chamber with optical access. The jet was imaged at different timings after start of injection and its time evolution was analyzed as a function of injection pressure and needle lift.

Modern Diesel engines have become ever more complex systems with many degrees of freedom. Simultaneously, with increasing computational power, simulations of engines have become more popular, and can be used to find the optimum set up of engine operation parameters which result in the desired point in the emission-efficiency trade off. With increasing number of engine operation parameter combinations, the number of calculations increase exponentially. Therefore, adequate models for combustion and emissions with limited calculation costs are required. For obvious reasons, the accuracy of the ignition timing is a key point for the following combustion and emission model quality. Furthermore, the combination of mixing and chemical processes during the ignition delay is very challenging to model in a fast way for a wide range of operation conditions.

The combustion of gaseous fuels like methane in internal combustion engines is an interesting alternative to the conventional gasoline and diesel fuels. Reasons are the availability of the resource and the significant advantage in terms of CO2 emissions due to the beneficial C/H ratio. One difficulty of gaseous fuels is the preparation of the gas/air mixtures for all operation points, since the volumetric energy density of the fuel is lower compared to conventional liquid fuels. Low-pressure port-injected systems suffer from substantially reduced volumetric efficiencies. Direct injection systems avoid such losses; in order to deliver enough fuel into the cylinder, high pressures are however needed for the gas injection which forces the fuel to enter the cylinder at supersonic speed followed by a Mach disk. The detailed modeling of these physical effects is very challenging, since the fluid velocities and pressure and velocity gradients at the Mach disc are very high.