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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.

Many recent studies have shown that the Reactivity Controlled Compression Ignition (RCCI) combustion strategy can achieve high efficiency with low emissions. However, it has also been revealed that RCCI combustion is difficult at high loads due to its premixed nature. To operate at moderate to high loads with gasoline/diesel dual fuel, high amounts of EGR or an ultra low compression ratio have shown to be required. Considering that both of these approaches inherently lower thermodynamic efficiency, in this study natural gas was utilized as a replacement for gasoline as the low-reactivity fuel. Due to the lower reactivity (i.e., higher octane number) of natural gas compared to gasoline, it was hypothesized to be a better fuel for RCCI combustion, in which a large reactivity gradient between the two fuels is beneficial in controlling the maximum pressure rise rate.

A modified version of the multi-dimensional KIVA-II code is used to model the effects of multiple injection schemes and exhaust gas recirculation (EGR) on direct injected diesel engine NOx and soot emissions. The computational results, which also considered double and triple injection schemes and varying EGR amounts, are compared with experimental data obtained from a single cylinder version of a Caterpillar heavy-duty truck engine. The study is done at high load (75% of peak torque at 1600 rpm) where EGR is known to produce unacceptable increases in soot (particulate). The effect of soot and spray model formulations are considered. This includes a new spray model based on Rayleigh-Taylor instabilities for liquid breakup. A soot oxidation model that accounts for turbulent mixing and kinetic effects were found to give accurate results. The results showed excellent agreement between predicted and measured in-cylinder pressure, and heat release data for the various cases.

Two-Color imaging optics were developed and used to observe soot emission processes in a modern heavy-duty diesel engine. The engine was equipped with a common rail, electronically-controlled, high-pressure fuel injection system that is capable of up to four injection pulses per engine cycle. The engine was instrumented with an endoscope system for optical access for the combustion visualization. Multidimensional combustion and soot modeling results were used for comparisons to enhance the understanding and interpretation of the experimental data. Good agreement between computed and measured cylinder pressures, heat release and soot and NOx emissions was achieved. In addition, good qualitative agreement was found between in-cylinder soot concentration (KL) and temperature fields obtained from the endoscope images and those obtained from the multidimensional modeling.

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.

This research explored methods to reduce regulated emissions in a small-bore, direct-injection diesel engine. Swirl was used to influence mixing of the spray plumes, and alternative fuels were used to study the effects of oxygenated and water microemulsion diesel fuels on emissions. Air/fuel mixing enhancement was achieved in the running engine by blocking off a percentage of one of the two intake ports. The swirl was characterized at steady-state conditions with a flowbench and swirl meter. Swirl ratios of 1.85, 2.70, and 3.29 were studied in the engine tests at full load with engine speeds of 1303, 1757, and 1906 rev/min. Increased swirl was shown to have negative effects on emissions due to plume-to-plume interactions. Blends of No. 2 diesel and biodiesel were used to investigate the presence of oxygen in the fuel and its effects on regulated emissions. Pure No. 2 diesel fuel, a 15% and a 30% biodiesel blend (by weight) were used.

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.

Due to concerns regarding pollutant and CO2 emissions, advanced combustion modes that can simultaneously reduce exhaust emissions and improve thermal efficiency have been widely investigated. The main characteristic of the new combustion strategies, such as HCCI and LTC, is that the formation of a homogenous mixture or a controllable stratified mixture is required prior to ignition. The major issue with these approaches is the lack of a direct method for the control of ignition timing and combustion rate, which can be only indirectly controlled using high EGR rates and/or lean mixtures. Homogeneous Charge Progressive Combustion (HCPC) is based on the split-cycle principle. Intake and compression phases are performed in a reciprocating external compressor, which drives the air into the combustor cylinder during the combustion process, through a transfer duct. A transfer valve is positioned between the compressor cylinder and the transfer duct.

In a recent study, quantitative measurements were presented of in-cylinder spatial distributions of mixture equivalence ratio in a single-cylinder light-duty optical diesel engine, operated with a non-reactive mixture at conditions similar to an early injection low-temperature combustion mode. In the experiments a planar laser-induced fluorescence (PLIF) methodology was used to obtain local mixture equivalence ratio values based on a diesel fuel surrogate (75% n-heptane, 25% iso-octane), with a small fraction of toluene as fluorescing tracer (0.5% by mass). Significant changes in the mixture's structure and composition at the walls were observed due to increased charge motion at high swirl and injection pressure levels. This suggested a non-negligible impact on wall heat transfer and, ultimately, on efficiency and engine-out emissions.

Engine-out CO emission and fuel conversion efficiency were measured in a highly-dilute, low-temperature diesel combustion regime over a swirl ratio range of 1.44-7.12 and a wide range of injection timing. At fixed injection timing, an optimal swirl ratio for minimum CO emission and fuel consumption was found. At fixed swirl ratio, CO emission and fuel consumption generally decreased as injection timing was advanced. Moreover, a sudden decrease in CO emission was observed at early injection timings. Multi-dimensional numerical simulations, pressure-based measurements of ignition delay and apparent heat release, estimates of peak flame temperature, imaging of natural combustion luminosity and spray/wall interactions, and Laser Doppler Velocimeter (LDV) measurements of in-cylinder turbulence levels are employed to clarify the sources of the observed behavior.

A new spray model has been developed to improve the prediction of diesel engine combustion and emissions using the KIVA-II CFD code. The accuracy of modeling the spray breakup process has been improved by the inclusion of Rayleigh-Taylor accelerative instabilities, which are calculated simultaneously with a Kelvin-Helmholtz wave model. This model improves the prediction of the droplet sizes within a diesel spray and provides a more accurate initial condition for the evaporation, combustion, and emissions models. An improvement to the droplet drag model is also presented. This model accounts for the increased droplet drag due to the change in the droplet's shape, as well as the increase in the frontal area of the droplet. The drag model affects the breakup process locally, producing a more realistic droplet size distribution, and therefore a more accurate calculation of the vaporization process.

Rate shaping of the fuel injection process is known to significantly impact emissions production in diesel engines. To demonstrate the ability of multidimensional engine modeling to quantify and explain the effect of rate shaping and injection duration, three injection profiles typical of common diesel fuel injection systems were investigated for three injection durations and injection timings. The present study uses an improved version of the KIVA-II engine simulation code employing the characteristic time combustion model, the Kelvin-Helmholtz and the Rayleigh-Taylor spray atomization mechanisms, the extended Zeldovich thermal NOx production model, and a single species soot model.

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.

The three-dimensional KIVA code has been used to study the effects of injection pressure and split injections on diesel engine performance and soot and NOx emissions. The code has been updated with state-of-the-art submodels including: a wave breakup atomization model, drop drag with drop distortion, spray/wall interaction with sliding, rebounding, and breaking-up drops, multistep kinetics ignition and laminar-turbulent characteristic time combustion, wall heat transfer with unsteadiness and compressibility, Zeldovich NOx formation, and soot formation with Nagle Strickland-Constable oxidation. The computational results are compared with experimental data from a single-cylinder Caterpillar research engine equipped with a high-pressure, electronically-controlled fuel injection system, a full-dilution tunnel for soot measurements, and gaseous emissions instrumentation.

An experimental study has been completed which evaluated the effectiveness of using double, triple and rate shaped injections to simultaneously reduce particulate and NOx emissions. The experiments were done using a single cylinder version of a Caterpillar 3406 heavy duty D.I. diesel engine. The fuel system used was a common rail, electronically controlled injector that allowed flexibility in both the number and duration of injections per cycle. Injection timing was varied for each injection scheme to evaluate the particulate vs. NOx tradeoff and fuel consumption. Tests were done at 1600 rpm using engine load conditions of 25% and 75% of maximum torque. The results indicate that a double injection with a significantly long delay between injections reduced particulate by as much as a factor of three over a single injection at 75% load with no increase in NOx. Double injections with a smaller dwell gave less improvement in particulate and NOx at 75% load.

This study was conducted to develop an understanding of how rate-shaped and split injections can affect the soot and NOx emissions of a heavy-duty diesel engine. The tests were performed on a single cylinder version of the Caterpillar 3406 production engine, modified to accept an electronically-controlled, high-pressure common-rail injection system that offers a very high degree of flexibility in injection timing, split injections, and rate shaping of the initial injection. The engine was instrumented for particulate measurements with a full dilution tunnel, and CO, CO2 and NOx emission meters. Cylinder pressure was used to study heat release rates, and the response to changes in the injection scheme. The results show that rate-shaped injection, when optimized for lowest BSFC, does not appreciably affect pressure rise or peak cylinder gas pressures.

The development of analytic models of diesel engine flow, combustion and subprocesses is described. The models are intended for use as design tools by industry for the prediction of engine performance and emissions to help reduce engine development time and costs. Part of the research program includes performing engine experiments to provide validation data for the models. The experiments are performed on a single-cylinder version of the Caterpillar 3406 engine that is equipped with state-of-the-art high pressure electronic fuel injection and emissions instrumentation. In-cylinder gas velocity and gas temperature measurements have also been made to characterize the flows in the engine.

An emissions and performance study was conducted to explore the effects of EGR and multiple injections on particulate, NOx, and BSFC. EGR is known to be effective at reducing NOx, but at high loads there is usually a large increase in particulate. Recent work has shown that multiple injections are effective at reducing particulate. Thus, it was of interest to examine the possibility of simultaneously reducing particulate and NOx with the combined use of EGR and multiple injections. The tests were conducted on a fully instrumented single cylinder version of the Caterpillar 3406 heavy duty truck engine. Tests were done at high load (75% of peak torque at 1600 RPM where EGR has been shown to produce unacceptable increases in particulate emissions. The fuel system used was an electronically controlled, common rail injector and supporting hardware. The fuel system was capable of up to four independent injections per cycle.

An image acquisition-and-processing camera system was developed for in-cylinder diagnostics of a single-cylinder heavy duty diesel engine. The engine was equipped with an electronically-controlled common-rail fuel injection system that allowed both single and split (multiple) injections to be studied. The imaging system uses an endoscope to acquire luminous flame images from the combustion chamber and ensures minimum modification to the engine geometry. The system also includes an optical linkage, an image intensifier, a CID camera, a frame grabber, control circuitry and a computer. Experiments include both single and split injection cases at 90 MPa and 45 MPa injection pressures at 3/4 load and 1600 rev/min with simulated turbocharging. For the single injection at high injection pressure (90 MPa) the results show that the first luminous emissions from the ignition zone occur very close to the injector exit followed by rapid luminous flame spreading.