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Diesel particulate filters are designed to reduce the mass emissions of diesel particulate matter and have been proven to be effective in this respect. Not much is known, however, about their effects on other unregulated chemical species. This study utilized source dilution sampling techniques to evaluate the effects of a catalyzed diesel particulate filter on a wide spectrum of chemical emissions from a heavy-duty diesel engine. The species analyzed included both criteria and unregulated compounds such as particulate matter (PM), carbon monoxide (CO), hydrocarbons (HC), inorganic ions, trace metallic compounds, elemental and organic carbon (EC and OC), polycyclic aromatic hydrocarbons (PAHs), and other organic compounds. Results showed a significant reduction for the emissions of PM mass, CO, HC, metals, EC, OC, and PAHs.

The effect of the ring pack storage mechanism on the hydrocarbon (HC) emissions from an air-cooled utility engine has been studied using a simplified ring pack model. Tests were performed for a range of engine load, two engine speeds, varied air-fuel ratio and with a fixed ignition timing using a homogeneous, pre-vaporized fuel mixture system. The integrated mass of HC leaving the crevices from the end of combustion (the crank angle that the cumulative burn fraction reached 90%) to exhaust valve closing was taken to represent the potential contribution of the ring pack to the overall HC emissions; post-oxidation in the cylinder will consume some of this mass. Time-resolved exhaust HC concentration measurements were also performed, and the instantaneous exhaust HC mass flow rate was determined using the measured exhaust and cylinder pressure.

In multidimensional modeling, fuels have been represented predominantly by single components, such as octane for gasoline. Several bicomponent studies have been performed, but these are still limited in their ability to represent real fuels, which are blends of as many as 300 components. This study outlines a method by which the fuel composition is represented by a distribution function of the fuel molecular weight. This allows a much wider range of compositions to be modeled, and only requires including two additional “species” besides the fuel, namely the mean and second moment of the distribution. This approach has been previously presented but is applied here to multidimensional calculations. Results are presented for single component droplet vaporization for comparison with single component fuel predictions, as well as results for a multicomponent gasoline and a diesel droplet.

The contribution to the engine-out hydrocarbon (HC) emissions from fuel that escapes the main combustion event in piston ring crevices was estimated for an air-cooled, V-twin utility engine. The engine was run with a homogeneous pre-vaporized mixture system that avoids the presence of liquid films in the cylinder, and their resulting contribution to the HC emissions. A simplified ring pack gas flow model was used to estimate the ring pack contribution to HC emissions; the model was tested against the experimentally measured blowby. At high load conditions the model shows that the ring pack returns to the cylinder a mass of HC that exceeds that observed in the exhaust, and thus, is the dominant contributor to HC emissions. At light loads, however, the model predicts less HC mass returned from the ring pack than is observed in the exhaust. Time-resolved HC measurements were performed and used to assess the effect of combustion quality on HC emissions.

A multidimensional numerical simulation method was developed to analyze air/fuel premixing, stratified combustion and NOx emission formation in a gasoline direct injection (GDI) engine. Firstly, many submodels were integrated into one Computational Fluid Dynamics (CFD) code: ICFD-CN, such as Sarre nozzle flow, Kelvin-Helmholtz (KH) dynamic jet model, Taylor-Analogy Breakup (TAB) model, Rayleigh-Taylor (RT) droplet breakup model, Lefebvre fuel vaporization model, Liu droplet drag & distortion model, Gosman turbulence & droplet dispersion model, O'rourke wall film model, O'rourke and Bracco droplet impinging & coalescence model, Stanton spray/wall impinging model, the Discrete Particle Ignition Kernel(DPIK)ignition model, the single step combustion and the patulous Zeldovich model for NOx generation mechanism. The integrated CFD code was then calibrated against experimental data in a gasoline direct injection engine for several engine operating conditions.

The lift-off length plays a significant role in spray combustion as it influences the air entrainment upstream of the lift-off location and hence the soot formation. Accurate prediction of lift-off length thus becomes a prerequisite for accurate soot prediction in lifted flames. In the present study, KIVA-3v coupled with CHEMKIN, as developed at the Engine Research Center (ERC), is used as the CFD model. Experimental data from the Sandia National Labs. is used for validating the model predictions of n-heptane lift-off lengths and soot formation details in a constant volume combustion chamber. It is seen that the model predictions, in terms of lift-off length and soot mass, agree well with the experimental results for low ambient density (14.8 kg/m3) cases with different EGR rates (21% O2 - 8% O2). However, for high density cases (30 kg/m3) with different EGR rates (15% O2 - 8% O2) disagreements were found.

Multi-zone CFD simulations with detailed kinetics were used to model iso-octane HCCI experiments performed on a single-cylinder research engine. The modeling goals were to validate the method (multi-zone combustion modeling) and the reaction mechanism (LLNL 857 species iso-octane) by comparing model results to detailed exhaust speciation data, which was obtained with gas chromatography. The model is compared to experiments run at 1200 RPM and 1.35 bar boost pressure over an equivalence ratio range from 0.08 to 0.28. Fuel was introduced far upstream to ensure fuel and air homogeneity prior to entering the 13.8:1 compression ratio, shallow-bowl combustion chamber of this 4-stroke engine. The CFD grid incorporated a very detailed representation of the crevices, including the top-land ring crevice and head-gasket crevice. The ring crevice is resolved all the way into the ring pocket volume. The detailed grid was required to capture regions where emission species are formed and retained.

The influence of the addition of oxygenated hydrocarbons to diesel fuels has been studied, using a detailed chemical kinetic model. Resulting changes in ignition and soot precursor production have been examined. N-heptane was used as a representative diesel fuel, and methanol, ethanol, dimethyl ether, dimethoxymethane and methyl butanoate were used as oxygenated fuel additives. It was found that addition of oxygenated hydrocarbons reduced the production of soot precursors. When the overall oxygen content in the fuel reached approximately 30-40 % by mass, production of soot precursors fell effectively to zero, in agreement with experimental studies. The kinetic factors responsible for these observations are discussed.

We have developed a methodology for predicting combustion and emissions in a Homogeneous Charge Compression Ignition (HCCI) Engine. This methodology combines a detailed fluid mechanics code with a detailed chemical kinetics code. Instead of directly linking the two codes, which would require an extremely long computational time, the methodology consists of first running the fluid mechanics code to obtain temperature profiles as a function of time. These temperature profiles are then used as input to a multi-zone chemical kinetics code. The advantage of this procedure is that a small number of zones (10) is enough to obtain accurate results. This procedure achieves the benefits of linking the fluid mechanics and the chemical kinetics codes with a great reduction in the computational effort, to a level that can be handled with current computers.

An engine cycle simulation code with detailed chemical kinetics has been developed to study Homogeneous Charge Compression Ignition (HCCI) combustion with hydrogen as the fuel. In order to attain adequate combustion duration, resulting from the self-accelerating nature of the chemical reaction, fuel and temperature inhomogeneities have been brought to the calculation by considering the combustion chamber to have various temperature and fuel distributions. Calculations have been done under various conditions including both perfectly homogeneous and inhomogeneous cases, changing the degree of inhomogeneity. The results show that intake gas temperature is more dominant on ignition timing of HCCI than equivalence ratio and that there is a possibility to control HCCI by introducing appropriate temperature inhomogeneity to in-cylinder mixture.

We have developed a methodology for predicting combustion and emissions in a Homogeneous Charge Compression Ignition (HCCI) Engine. The methodology judiciously uses a fluid mechanics code followed by a chemical kinetics code to achieve great reduction in the computational requirements; to a level that can be handled with current computers. In previous papers, our sequential, multi-zone methodology has been applied to HCCI combustion of short-chain hydrocarbons (natural gas and propane). Applying the same procedure to long-chain hydrocarbons (iso-octane) results in unacceptably long computational time. In this paper, we show how the computational time can be made acceptable by developing a segregated solver. This reduces the run time of a ten-zone problem by an order of magnitude and thus makes it much more practical to make combustion studies of long-chain hydrocarbons.

A direct injection-gasoline (DI-G) system was applied to a heavy-duty diesel-type engine to study the effects of charge stratification on the performance of premixed compression ignited combustion. The effects of the fuel injection parameters on combustion phasing were of primary interest. The simultaneous effects of the fuel stratification on Unburned Hydrocarbon (UHC), Oxides of Nitrogen (NOx), Carbon Monoxide (CO), and smoke emissions were also measured. Engine tests were conducted with altered injection parameters covering the entire load range of normally aspirated Homogeneous Charge Compression Ignited (HCCI) combustion. Combustion phasing tests were also conducted at several engine speeds to evaluate its effects on a fuel stratification strategy.

The causes of Unburned Hydrocarbon (UHC) emissions from a premixed compression ignited engine were investigated for both homogeneous and stratified charge conditions. A fast response Flame Ionization Detector (fast FID) was used to provide cycle-resolved UHC exhaust emission measurements. These fast FID UHC measurements were coupled with numerical flow simulation results to provide quantitative and qualitative insight into the sources of UHC emissions. The combined results were used to evaluate the effects of engine load, local gas temperatures, fuel stratification, and crevice quenching on UHC emissions.

A multi-zone model has been developed that accurately predicts HCCI combustion and emissions. The multi-zone methodology is based on the observation that turbulence does not play a direct role on HCCI combustion. Instead, chemical kinetics dominates the process, with hotter zones reacting first, and then colder zones reacting in rapid succession. Here, the multi-zone model has been applied to analyze the effect of piston crevice geometry on HCCI combustion and emissions. Three different pistons of varying crevice size were analyzed. Crevice sizes were 0.26, 1.3 and 2.1 mm, while a constant compression ratio was maintained (17:1). The results show that the multi-zone model can predict pressure traces and heat release rates with good accuracy. Combustion efficiency is also predicted with good accuracy for all cases, with a maximum difference of 5% between experimental and numerical results.

The Diesel engine is a commercially attractive powerplant, however it is noted to have significant specific output of harmful emissions under some operating conditions. One possible solution for reduction of the harmful emissions from the Diesel engine is greater control over the fuel injection event. To gain further understanding of liquid phase Diesel fuel injection spray characteristics, a 2.44 liter displacement, 4 stroke engine was modified for optical access and fitted with a Caterpillar Hydraulic Electronic Unit Injection (HEUI) system. The data collection system consisted of a high repetition rate diode pumped Nd:YAG laser frequency doubled to 532 nm for visible illumination and a Kodak High Speed Motion Analyzer for recording fuel spray images. The engine was motored under various inlet conditions to create an engine combustion chamber environment typical of those found in commercial engines of similar per cylinder displacement class.

In this work, linear, non-linear and a generalized renormalization group (RNG) two-equation RANS turbulence models of the k-epsilon form were compared for the prediction of turbulent compressible flows in diesel engines. The object-oriented, multidimensional parallel code FRESCO, developed at the University of Wisconsin, was used to test the alternative models versus the standard k-epsilon model. Test cases featured the academic backward facing step and the impinging gas jet in a quiescent chamber. Diesel engine flows featured high-pressure spray injection in a constant volume vessel from the Engine Combustion Network (ECN), as well as intake flows in a high-swirl diesel engine. For the engine intake flows, a model of the Sandia National Laboratories 1.9L light-duty single cylinder optical engine was used.

Intake port and cylinder flow have been modeled for a dual intake valve diesel engine. A block structured grid was used to represent the complex geometry of the intake port, valves, and cylinder. The calculations were made using a pre-release version of the KIVA-3 code developed at Los Alamos National Laboratories. Both steady flow-bench and unsteady intake calculations were made. In the flow bench configuration, the valves were stationary in a fully open position and pressure boundary conditions were implemented at the domain inlet and outlet. Detailed structure of the in-cylinder flow field set up by the intake flow was studied. Three dimensional particle trace streamlines reveal a complex flow structure that is not readily described by global parameters such as swirl or tumble. Streamlines constrained to lie in planes normal to the cylinder axis show dual vortical structures, which originated at the valves, merging into a single structure downstream.

The three-dimensional computer code, KIVA, is being modified to include state-of-the-art submodels for diesel engine flow and combustion. Improved and/or new submodels which have already been implemented are: wall heat transfer with unsteadiness and compressibility, laminar-turbulent characteristic time combustion with unburned HC and Zeldo'vich NOx, and spray/wall impingement with rebounding and sliding drops. Progress on the implementation of improved spray drop drag and drop breakup models, the formulation and testing of a multistep kinetics ignition model and preliminary soot modeling results are described. In addition, the use of a block structured version of KIVA to model the intake flow process is described. A grid generation scheme has been developed for modeling realistic (complex) engine geometries, and initial computations have been made of intake flow in the manifold and combustion chamber of a two-intake-valve engine.

This research focused on the effects of split injection on combustion in a diesel environment. It was done in a specially designed engine-fed combustion chamber (swirl ratio of 5) with full field optical access through a quartz window. The simulated engine combustion chamber used a special backwards spraying injector (105°). The electronically controlled injector could control the size and position of it's, two injections. Both injections were through the same nozzle and it produced very rapid injections (1.5 ms) with a maximum injection pressure of 130 MPa. Experimental data included: rate of injection, injector pressure, combustion chamber dumping (NO & NOx concentrations), flame temperature, KL factor (soot concentration) combustion pressure, and rate of pressure rise. Injection rates indicate that the UCORS injection system creates very rapid injections with the ability to produce controllable split injections.

A new technique which is based on optoacoustic phenomena has been developed for measuring in-cylinder gas temperature and turbulent diffusivity. In the experiments, a high energy Nd:YAG pulsed laser beam was focused to cause local ionization of air at a point in the combustion chamber. This initiates a shock wave and creates a hot spot. The local temperature and turbulent diffusivity are determined by monitoring the shock propagation and the hot spot growth, respectively, with a schlieren photography system. In order to assess the validity and accuracy of the measurements, the technique was also applied to a turbulent jet. The temperature measurements were found to be accurate to within 3%. Results from the turbulent jet measurements also showed that the growth rate of the hot spot diameter can be used to estimate the turbulent diffusivity. In-cylinder gas temperature measurements were made in a motored single cylinder Caterpillar diesel engine, modified for optical access.