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An integrated numerical model has been developed for diesel engine computations based on the KIVA-II code. The model incorporates a modified RNG k-ε, turbulence model, a ‘wave’ breakup spray model, the Shell ignition model, the laminar-and-turbulent characteristic-time combustion model, a crevice flow model, a spray/wall impingement model that includes rebounding and breaking-up drops, and other improved submodels in the KIVA code. The model was validated and applied to model successfully different types of diesel engines under various operating conditions. These engines include a Caterpillar engine with different injection pressures at different injection timings, a small Tacom engine at different loads, and a Cummins engine modified by Sandia for optical experiments. Good levels of agreement in cylinder pressures and heat release rate data were obtained using the same computer model for all engine cases.

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.

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 objective of this study was to observe and attempt to understand the effects of equivalence ratio and simulated exhaust gas recirculation (EGR) on the exhaust emissions and performance of a L-head single cylinder utility engine. In order to isolate these effects and limit the confounding influences caused by poor fuel mixture preparation and/or vaporization produced by the carburetor/intake port combination, the engine was operated on a premixed propane/air mixture. To simulate the effects of EGR, a homogeneous mixture of propane, air, and nitrogen was used. Engine measurements were obtained at the operating conditions specified by the California Air Resources Board (CARB) Raw Gas Method Test Procedure. Measurements included exhaust emissions levels of HC, CO, and NOx, and engine pressure data.

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.

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.

An experimental investigation of the spectral characteristics of turbulent flow in a scale model of a high pressure diesel fuel injector nozzle hole has been conducted. Instantaneous velocity measurements were made in a 50X transparent model of one hole of an injector nozzle using an Aerometrics Phase/Doppler Particle Analyzer (PDPA) in the velocity mode. Turbulence spectra were calculated from the velocity data using the Lomb-Scargle method. Injector hole length to diameter ratio (L/D) values of 1.3, 2.4, 4.9, and 7.7 and inlet radius to diameter ratio (R/D) values of approximately 0 and 0.3 were investigated. Results were obtained for a steady flow average Reynolds number of 10,500, which is analogous to a fuel injection velocity of 320 m/s and a sac pressure of approximately 67 MPa (10,000 psi). Turbulence time frequency spectra were obtained for significant locations in each geometry, in order to determine how geometry affects the development of the turbulent spectra.

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.

An experimental investigation of turbulent flow patterns in a scale model of a high pressure diesel fuel injector nozzle has been conducted. Instantaneous velocity measurements were made in a 50X transparent model of one hole of the injector nozzle using an Aerometrics Phase Doppler Particle Analyzer (PDPA) in the velocity mode. Length to diameter ratio (L/D) values of 1.3, 2.4, 4.9, and 7.7 and inlet radius to diameter ratio (R/D) values of approximately 0 and 0.3 were investigated. Two steady flow average Reynolds numbers (10,500 and 13,300), analogous to fuel injection velocities and sac pressures of approximately 320 and 405 m/s and 67 and 107 MPa (10,000 and 16,000 psi), were investigated. The axial progression of mean and root mean square (rms) axial velocities was obtained for both sharp and rounded inlet conditions and varying L/D. The discharge coefficient was also calculated for each geometry.

A three-dimensional computer code (KIVA) is being modified to include state-of-the-art submodels for diesel engine flow and combustion: spray atomization, drop breakup/coalescence, multi-component fuel vaporization, spray/wall interaction, ignition and combustion, wall heat transfer, unburned HC and NOx formation, soot and radiation and the intake flow process. Improved and/or new submodels which have been completed 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.

Diesel engine in-cylinder combustion processes have been studied using computational models with particular attention to spray development, vaporization, fuel/air mixture formation and combustion. A thermodynamic zero-dimensional cycle analysis program was used to determine initial conditions for the multidimensional calculations. A modified version of the time-dependent, three-dimensional computational fluid dynamics code KIVA-II was used for the computations, with a detailed treatment for the spray calculations and a simplified model for combustion. The calculations were used to obtain an understanding of the potential predictive capabilities of the models. It was found that there is a strong sensitivity of the results to numerical grid resolution. With proper grid resolution, the calculations were found to reproduce experimental data for non- vaporizing and vaporizing sprays. However, for vaporizing sprays with combustion, extremely fine grids are needed.

A single cylinder, Cummins NH, direct-injection, diesel engine has been operated in order to evaluate the effects of aromatic content and aromatic structure on diesel engine particulates. Results from three fuels are shown. The first fuel, a low sulfur Chevron diesel fuel was used as a base fuel for comparison. The other fuels consisted of the base fuel and 10% by volume of 1-2-3-4 tetrahydronaphthalene (tetralin) a single-ring aromatic and naphthalene, a double-ring aromatic. The fuels were chosen to vary aromatic content and structure while minimizing differences in boiling points and cetane number. Measurements included exhaust particulates using a mini-dilution tunnel, exhaust emissions including THC, CO2, NO/NOx, O2, injection timing, two-color radiation, soluble organic fraction, and cylinder pressure. Particulate measurements were found to be sensitive to temperature and flow conditions in the mini-dilution tunnel and exhaust system.