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A computational study using multi-dimensional CFD modeling was performed to investigate the effects of physical properties on diesel engine combustion characteristics with bio-diesel fuels. Properties of typical bio-diesel fuels that were either calculated or measured are used in the study and the simulation results are compared with those of conventional diesel fuels. The sensitivity of the computational results to individual physical properties is also investigated, and the results provide information about the desirable characteristics of the blended fuels. The properties considered in the study include liquid density, vapor pressure, surface tension, liquid viscosity, liquid thermal conductivity, liquid specific heat, latent heat, vapor specific heat, vapor diffusion coefficient, vapor viscosity and vapor thermal conductivity. The results show significant effects of the fuel physical properties on ignition delay and burning rates at various engine operating conditions.

A transport equation residual model incorporating refined G-equation and detailed chemical kinetics combustion models has been developed and implemented in the ERC KIVA-3V release2 code for Gasoline Direct Injection (GDI) engine simulations for better predictions of flame propagation. In the transport equation residual model a fictitious species concept is introduced to account for the residual gases in the cylinder, which have a great effect on the laminar flame speed. The residual gases include CO2, H2O and N2 remaining from the previous engine cycle or introduced using EGR. This pseudo species is described by a transport equation. The transport equation residual model differentiates between CO2 and H2O from the previous engine cycle or EGR and that which is from the combustion products of the current engine cycle.

A computational study was performed to evaluate the effects of bowl geometry, fuel spray targeting and swirl ratio under highly diluted, low-temperature combustion conditions in a heavy-duty diesel engine. This study is used to examine aspects of low-temperature combustion that are affected by mixing processes and offers insight into the effect these processes have on emissions formation and oxidation. The foundation for this exploratory study stems from a large data set which was generated using a genetic algorithm optimization methodology. The main results suggest that an optimal combination of spray targeting, swirl ratio and bowl geometry exist to simultaneously minimize emissions formation and improve soot and CO oxidation rates. Spray targeting was found to have a significant impact on the emissions and fuel consumption performance, and was furthermore found to be the most influential design parameter explored in this study.

A multi-objective genetic algorithm methodology was applied to a heavy-duty diesel engine at three different operating conditions of interest. Separate optimizations were performed over various fuel injection nozzle parameters, piston bowl geometries and swirl ratios (SR). Different beginning of injection (BOI) timings were considered in all optimizations. The objective of the optimizations was to find the best possible fuel economy, NOx, and soot emissions tradeoffs. The input parameter ranges were determined using design of experiment methodology. A non-dominated sorting genetic algorithm II (NSGA II) was used for the optimization. For the optimization of piston bowl geometry, an automated grid generator was used for efficient mesh generation with variable geometry parameters. The KIVA3V release 2 code with improved ERC sub-models was used. The characteristic time combustion (CTC) model was employed to improve computational efficiency.

A reduced chemical reaction mechanism is developed and validated in the present study for multi-dimensional diesel HCCI engine combustion simulations. The motivation for the development of the reduced mechanism is to enhance the computational efficiency of engine stimulations. The new reduced mechanism was generated starting from an existing n-heptane mechanism (40 species and 165 reactions). The procedure of generating the reduced mechanism included: using SENKIN to produce the ignition delay data and solution files, using XSENKPLOT to analyze the base mechanism and to identify important reactions and species, eliminating unimportant species and reactions, formulating the new reduced mechanism, using the new mechanism to generate ignition delay data, and finally adjusting kinetic constants in the new mechanism to improve ignition delay and engine combustion predictions to account for diesel fuel cetane number and composition effects.

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.

Particle Image Velocimetry (PIV) was used to make gas velocity and turbulence measurements in a motored diesel engine. The experiments were conducted using a single-cylinder version of the Caterpillar 3406 production engine. One of the exhaust valves and the fuel injector port were used to provide optical access to the combustion chamber so that modifications to the engine geometry were minimal, and the results are representative of the actual engine. Measurements of gas velocity were made in a plane in the piston bowl using TiO2 seed particles. The light sheet necessary for PIV was formed by passing the beam from a Nd:YAG laser through the injector port and reflecting the beam off a conical mirror at the center of the piston. PIV data was difficult to obtain due to significant out-of-plane velocities. However, data was acquired at 25° and 15° before top dead center of compression at 750 rev/min.

Progress on the development and validation of a CFD model for diesel engine combustion and flow is described. A modified version of the KIVA code is used for the computations, with improved submodels for liquid breakup, drop distortion and drag, spray/wall impingement with rebounding, sliding and breaking-up drops, wall heat transfer with unsteadiness and compressibility, multistep kinetics ignition and laminar-turbulent characteristic time combustion models, Zeldovich NOx formation, and soot formation with Nagle Strickland-Constable oxidation. The code also considers piston-cylinder-liner crevice flows and allows computations of the intake flow process in the realistic engine geometry with two moving intake valves. Significant progress has been made using a modified RNG k-ε turbulence model, and a multicomponent fuel vaporization model and a flamelet combustion model have been implemented.

Improved atomization is important in fuel injection applications since atomization influences fuel-air mixing and vaporization rates. The present paper explores the use of low pressure gas/air injection and methods to achieve a dispersed two-phase flow to enhance the atomization process. Gas-driven twin-fluid atomization has been achieved by combining X-ray lithographic/micro-machining technology to mechanically disperse a driving gas into a liquid to be sprayed. This technique forces the gas through a designed pattern of micron sized holes thereby yielding a field of micro-bubbles immediately upstream of the < I mm. diameter discharge orifice. Precise control of both uniformity of hole diameter and inter-hole spacing is critical to producing a well dispersed bubbly flow. The results show that the method of gas injection influences the liquid breakup process. Results are given for steady-flow atomization with low pressure injection into ambient air.

It is well known that the accuracy of simulations of combustion processes in diesel and spark ignited (SI) engines depends on the initial conditions within the cylinder at intake valve closure (IVC). Residual gas affects the engine combustion processes through its influence on charge mass, temperature and dilution. In SI engines, there is little oxygen in the residual gas, and thus the dilution effect on flame propagation is more significant than in compression ignited (CI) engines. However, in CI engines, the ignition delay depends strongly on the in-cylinder gas temperature, which is proportional to the gas temperature at IVC. Furthermore, ignition delay is significantly affected by how much oxygen is present, which is also partly determined by the residual gas fraction. Therefore, it is of extreme importance to determine residual gas concentrations accurately.

A numerical simulation and optimization study was conducted for a medium speed direct injection diesel engine. The engine's operating characteristics were first matched to available experimental data to test the validity of the numerical model. The KIVA-3V ERC CFD code was then modified to allow independent spray events from two rows of nozzle holes. The angular alignment, nozzle hole size, and injection pressure of each set of nozzle holes were optimized using a micro-genetic algorithm. The design fitness criteria were based on a multi-variable merit function with inputs of emissions of soot, NOx, unburned hydrocarbons, and fuel consumption targets. Penalties to the merit function value were used to limit the maximum in-cylinder pressure and the burned gas temperature at exhaust valve opening. The optimization produced a 28.4% decrease in NOx and a 40% decrease in soot from the baseline case, while giving a 3.1% improvement in fuel economy.

In the Atomization regime, liquid jets breakup either within the nozzle or immediately upon entering the chamber gas and drops much smaller than the jet diameter are formed. The mechanism of Atomization, which is presently unknown, was investigated by the simultaneous use of two photographic techniques. The initial transient was observed with a 106 frames/s camera and the steady state by a technique similar to spark photography. The experiment range was: liquid pressure 500 to 2500 psia; five mixtures of water and glycerol to vary the liquid viscosity; air, nitrogen, helium, and xenon at up to 600 psia as chamber gases to separate gas pressure from gas density effects; and 14 nozzle designs. Not changed were the temperature (room value), the nozzle diameter (340 μ), and the surface tension (70 dyne/cm).

While Low Temperature Combustion (LTC) strategies such as Reactivity Controlled Compression Ignition (RCCI) exhibit high thermal efficiency and produce low NOx and soot emissions, low load operation is still a significant challenge due to high unburnt hydrocarbon (UHC) and carbon monoxide (CO) emissions, which occur as a result of poor combustion efficiencies at these operating points. Furthermore, the exhaust gas temperatures are insufficient to light-off the Diesel Oxidation Catalyst (DOC), thereby resulting in poor UHC and CO conversion efficiencies by the aftertreatment system. To achieve exhaust gas temperature values sufficient for DOC light-off, combustion can be appropriately phased by changing the ratio of gasoline to diesel in the cylinder, or by burning additional fuel injected during the expansion stroke through post-injection.

In Equation 10, there should be a plus sign between the first summation term and the quantity in brackets. The acceleration of the participant's vehicle was varied from −0.04 m/s2 to +0.06 m/s2 linearly as a function of the angle of the gas pedal with a 0.1-second delay.