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Styrene, or ethylbenzene, is mainly used as a monomer for the production of polymers, most notably Styrofoam. In the synthetis of styrene, the feedstock of benzene and ethylene is converted into aromatic oxygenates such as benzaldehyde, 2-phenyl ethanol and acetophenone. Benzaldehyde and phenyl ethanol are low value side streams, while acetophenone is a high value intermediate product. The side streams are now principally rejected from the process and burnt for process heat. Previous in-house research has shown that such aromatic oxygenates are suitable as diesel fuel additives and can in some cases improve the soot-NOx trade-off. In this study acetophenone, benzaldehyde and 2-phenyl ethanol are each added to commercial EN590 diesel at a ratio of 1:9, with the goal to ascertain whether or not the lower value benzaldehyde and 2-phenyl ethanol can perform on par with the higher value acetophenone. These compounds are now used in pure form.

This paper presents a large eddy simulation study of the liquid spray mixing with hot ambient gas in a constant volume vessel under engine-like conditions with the injection pressure of 1500 bar, ambient density 22.8 kg/m₃, ambient temperature of 900 K and an injector nozzle of 0.09 mm. The simulation results are compared with the experiments carried out by Pickett et al., under similar conditions. Under modern direct injection diesel engine conditions, it has been argued that the liquid core region is small and the droplets after atomization are fine so that the process of spray evaporation and mixing with the air is controlled by the heat and mass transfer between the ambient hot gas and central fuel flow. To examine this hypothesis a simple spray breakup model is tested in the present LES simulation. The simulations are performed using an open source compressible flow solver, in OpenFOAM.

This project is one component of a broader effort whose ultimate goal is to provide CFD-based tools that can be used to optimize the design of urea SCR NOx aftertreatment systems for heavy-duty diesel engines. Here the focus is on predicting the distributions of key chemical species (ammonia, in particular) at the inlet to the catalysts. Two aspects of the physical models have been emphasized: the multi-phase models, and the gas-phase chemistry models. A hierarchy of four simplified geometric configurations has been used for model development and parametric studies, and to establish the appropriate level of physical modeling and numerical fidelity required. The resulting physical and numerical parameters then have been used to model a production SCR system. Initial quantitative comparisons with experimental measurements are encouraging.

Unburned hydrocarbon (UHC) and carbon monoxide (CO) emission sources are examined in an optical, light-duty diesel engine operating under low load and engine speed, while employing a highly dilute, partially premixed low-temperature combustion (LTC) strategy. The impact of engine load and charge dilution on the UHC and CO sources is also evaluated. The progression of in-cylinder mixing and combustion processes is studied using ultraviolet planar laser-induced fluorescence (UV PLIF) to measure the spatial distributions of liquid- and vapor-phase hydrocarbon. A separate, deep-UV LIF technique is used to examine the clearance volume spatial distribution and composition of late-cycle UHC and CO. Homogeneous reactor simulations, utilizing detailed chemical kinetics and constrained by the measured cylinder pressure, are used to examine the impact of charge dilution and initial stoichiometry on oxidation behavior.

The paper describes a novel method for calculating the residual gas fraction and the trapping efficiency in a 2 stroke engine. Assuming one dimensional compressible flow through the inlet and exhaust ports, the method estimates the instantaneous mass flowing in and out from the combustion chamber; later the residual gas fraction and trapping efficiency are estimated combining together the perfect displacement and perfect mixing scavenging models. It is assumed that when the intake port opens, the fresh mixture is pushing out the burned charge without any mixing and after a multiple of the time needed for the largest eddy to perform one rotation, the two gasses are instantly mixed up together and expelled. The result is a very simple algorithm that does not require much computational time and is able to estimate with high level of precision the trapping efficiency and the residual gas fraction in 2 stroke engines.

It has been known from multi-zone simulations that HCCI combustion can be significantly affected by temperature stratification of the in-cylinder gas. With the same combustion timing (i.e. crank angles at 50% heat release, denoted as CA50), large temperature stratification tends to prolong the combustion duration and lower down the in-cylinder pressure-rise-rate. With low pressure-rise-rate HCCI engines can be operated at high load, therefore it is of practical importance to look into more details about how temperature stratification affects the auto-ignition process. It has been realized that multi-zone simulations can not account for the effects of spatial structures of the stratified temperature field, i.e. how the size of the hot and cold spots in the temperature field could affect the auto-ignition process. This question is investigated in the present work by large eddy simulation (LES) method which is capable of resolving the in-cylinder turbulence field in space and time.

In this work, we conducted three-dimensional numerical simulations to investigate the effect of ultra-high injection pressure on diesel ignition and flame under high-boost and medium-load conditions. Three injection cases employed in experiments with a multi-cylinder Volvo D12 engine were applied for validation. The simulations were performed using the KIVA-3V code, with a Kelvin-Helmholz/Rayleigh-Taylor (KH/RT) spray breakup model and a diesel surrogate mechanism involving 83 species and 445 reactions. A range of higher injection pressure levels were projected and the injection rates estimated for the current study. Three different rate shapes of injection were projected and investigated as well. All the projected injection events start at top dead center (TDC). Computations demonstrate that high-pressure injection strongly affects engine ignition and combustion.

Nowadays for small-scale power generation there are electrochemical batteries and mini engines. Many efforts have been done for improving the power density of the batteries but unfortunately the value of 1 MJ/kg seems to be asymptotic. If the energy source is an organic fuel which has an energy density of around 29 MJ/kg with a minimum overall efficiency of only 3.5%, this device would surpass the batteries. This paper is the fifth of a series of publications aimed to study the HCCI combustion process in the milli domain at high engine speed in order to design and develop VIMPA, Vibrating Microengine for Low Power Generation and Microsystems Actuation. Previous studies ranged from general characterization of the HCCI combustion process by using metal and optical engines, to more specific topics for instance the influence of the boundary layer and quenching distance on the quality of the combustion.

Power supply systems play a very important role in applications of everyday life. Mainly, for low power generation, there are two ways of producing energy: electrochemical batteries and small engines. In the last few years many improvements have been carried out in order to obtain lighter batteries with longer duration but unfortunately the energy density of 1 MJ/kg seems to be an asymptotic value. If the energy source is an organic fuel with an energy density of around 29 MJ/kg and a minimum overall efficiency of only 3.5%, this device can surpass the batteries. Nowadays the most efficient combustion process is HCCI combustion which is able to combine high energy conversion efficiency and low emission levels with a very low fuel consumption. In this paper, an investigation has been carried out concerning the effects of the compression ratio on the performance and emissions of a mini, Vd = 4.11 [cm3], HCCI engine fueled with diethyl ether.

In HCCI you do not have the same control of the combustion like in SI and Diesel engines. Controlling the start of a combustion event is a difficult task and requires feedback from previous cycles. This feedback can be retrieved from ion current measurements. By applying a voltage over the spark gap, ions will lead a current and a signal that represents the combustion in the cylinder will be retrieved. Voltages of 450 V were used. The paper describes a new method to enhance the combustion phasing from the Ion current trace in HCCI engines. The method is using the knowledge of how the signal should look. This is known due to the fact that the shape of the ion current signal is similar from cycle to cycle. This new observation is shown in the paper. Also the correlation between the ion current and CA50 was studied. Later the signals have been used for combustion feedback.

Power supply systems play a very important role in everyday life applications. There are mainly two ways of producing energy for low power generation: electrochemical batteries and small engines. In the last few years, many improvements have been carried out in order to obtain lighter batteries with longer durations but unfortunately the energy density of 1 MJ/kg seems to be an asymptotic value. An energy source constituted of an organic fuel with an energy density around 29 MJ/kg and a minimum overall efficiency of only 3.5% could surpass batteries. Nowadays, the most efficient combustion process is HCCI combustion which has the ability to combine a high energy conversion efficiency with low emission levels and a very low fuel consumption. The present paper describes an investigation carried out on a modified model airplane engine, on how a pure HCCI combustion behaves in a small volume, Vd = 4.11 cm3, at very high engine speeds (up to 17,500 [rpm]).

An experimental study of a glow plug engine combustion process has been performed by applying chemiluminescence imaging. The major intent was to understand what kind of combustion is present in a glow plug engine and how the combustion process behaves in a small volume and at high engine speed. To achieve this, images of natural emitted light were taken and filters were applied for isolating the formaldehyde and hydroxyl species. Images were taken in a model airplane engine, 4.11 cm3, modified for optical access. The pictures were acquired using a high speed camera capable of taking one photo every second or fourth crank angle degree, and consequently visualizing the progress of the combustion process. The images were taken with the same operating condition at two different engine speeds: 9600 and 13400 rpm. A mixture of 65% methanol, 20% nitromethane and 15% lubricant was used as fuel.

Experiments on a modern DI Diesel engine were carried out: The engine was fuelled with standard Diesel fuel, RME and a mixture of 85% standard Diesel fuel, 5% RME and 10% higher alcohols under low load conditions (4 bar IMEP). During these experiments, different external EGR levels were applied while the injection timing was chosen in a way to keep the location of 50% heat release constant. Emission analysis results were in accordance with widely known correlations: Increasing EGR rates lowered NOx emissions. This is explained by a decrease of global air-fuel ratio entailing longer ignition delay. Local gas-fuel ratio increases during ignition delay and local combustion temperature is lowered. Exhaust gas analysis indicated further a strong increase of CO, PM and unburned HC emissions at high EGR levels. This resulted in lower combustion efficiency. PM emissions however, decreased above 50% EGR which was also in accordance with previously reported results.

High-speed video imaging in a swirl-supported (Rs = 1.7), direct-injection heavy-duty diesel engine operated with moderate-to-high EGR rates reveals a distinct correlation between the spatial distribution of luminous soot and mean flow vorticity in the horizontal plane. The temporal behavior of the experimental images, as well as the results of multi-dimensional numerical simulations, show that this soot-vorticity correlation is caused by the presence of a greater amount of soot on the windward side of the jet. The simulations indicate that while flow swirl can influence pre-ignition mixing processes as well as post-combustion soot oxidation processes, interactions between the swirl and the heat release can also influence mixing processes. Without swirl, combustion-generated gas flows influence mixing on both sides of the jet equally. In the presence of swirl, the heat release occurs on the leeward side of the fuel sprays.

Because of coming emission legislation emissions of nitrogen oxides and particular matter (PM) have to be substantially decreased. Several new concepts for low-emission engines have been proposed such as different variants on the HCCI engine but also engines with exhaust aftertreatment to reduce exhaust emissions. It is not only the engine design that influences emissions but also the fuel that is used. This study compares kerosene fuel with commercial diesel fuel. Kerosene fuel has considerable market availability since it is used in the aviation transport sector. Therefore it is possible to supply the land-based transportation sector with this fuel in relatively large quantities. Kerosene is a fuel with lower cetane number than diesel fuel, thus giving a longer ignition delay, making it viable for lower emissions since the longer ignition delay gives a longer time for the fuel to mix with the in-cylinder gas prior to combustion onset.

Nowadays the power supplying systems have a fundamental importance for all small and portable devices. For low power applications, there are two main ways for producing power: electrochemical batteries and mini engines. Even though in recent years many developments have been carried out in improving the design of batteries, the energy density of 1MJ/kg seems to be an asymptotic value. If the energy source is a hydrocarbon fuel, whose energy density is 46 MJ/kg, with an overall efficiency of only 2.5 % it is possible to surpass the electrochemical batteries. On the other hand, having a mini engine, as energy source, implies three main problems: vibrations, noise and emissions. A light (230 g) model airplane engine with a displacement volume of 4.11 cm3 and a geometrical compression ratio of 13.91 has been studied. The work carried out in this paper can be divided basically in three parts.

The possibilities for extending the range of engine loads in which soot and NOx emissions can be minimised by using low temperature combustion in conjunction with high levels of EGR was investigated in a series of experiments with a single cylinder research engine. The results show that very low levels of both soot and NOx emissions can be achieved at engine loads up to 50 % by reducing the compression ratio to 14 and applying high levels of EGR (up to approximately 60 %). Unfortunately, the low temperature combustion is accompanied by increases in fuel consumption and emissions of both HC and CO. However, these drawbacks can be reduced by advancing the injection timing. The research engine was a 2 litre direct injected (DI), supercharged, heavy duty, single cylinder diesel engine with a geometry based on Volvo's 12 litre engine, and the amount of EGR was increased by adjusting the exhaust back pressure while keeping the charge air pressure constant.

In this paper a fast NOx model is presented which can be used for engine optimization, aftertreatment control or virtual mapping. A cylinder pressure trace is required as input data. High calculation speed is obtained by using table interpolation to calculate equilibrium temperatures and species concentrations. Test data from a single-cylinder engine and from a complete six-cylinder engine have been used for calibration and validation of the model. The model produces results of good agreement with emission measurements using approximately 50 combustion product zones and a calculation time of one second per engine cycle. Different compression ratios, EGR rates, injection timing, inlet pressures etc. were used in the validation tests.

The main benefit of HCCI engines compared to SI engines is improved fuel economy. The drawback is the diluted combustion with a substantially smaller operating range if not some kind of supercharging is used. The reasons for the higher brake efficiency in HCCI engines can be summarized in lower pumping losses and higher thermodynamic efficiency, due to higher compression ratio and higher ratio of specific heats if air is used as dilution. In the low load operating range, where HCCI today is mainly used, other parameters as friction losses, and cooling losses have a large impact on the achieved brake efficiency. To initiate the auto ignition of the in-cylinder charge a certain temperature and pressure have to be reached for a specific fuel. In an engine with high in-cylinder cooling losses the initial charge temperature before compression has to be higher than on an engine with less heat transfer.

In practical applications of ammonia SCR aftertreatment systems using urea as the reductant storage compound, one major difficulty is the often constrained packaging envelope. As a consequence, complete mixing of the urea solution into the exhaust gas stream as well as uniform flow and reductant distribution profiles across the catalyst inlet face are difficult to achieve. This paper discusses a modeling approach, where a combination of 3D CFD and a lumped parameter SCR model enables the prediction of system performance, even with non-uniform exhaust flow and ammonia distribution profiles. From the urea injection nozzle to SCR catalyst exit, each step in the modeling process is described and validated individually. Finally the modeling approach was applied to a design study where the performance of a range of urea-exhaust gas mixing sections was evaluated.