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A dual fuel engine simulation model was formulated and the combustion process of a diesel/natural gas dual fuel engine was studied using an updated KIVA-3V Computational Fluid Dynamic (CFD) code. The dual fuel engine ignition and combustion process is complicated since it includes diesel injection, atomization and ignition, superimposed with premixed natural gas combustion. However, understanding of the combustion process is critical for engine performance optimization. Starting from a previously validated Characteristic-Timescale diesel combustion model, a natural gas combustion model was implemented and added to simulate the ignition and combustion process in a dual fuel bus engine. Available engine test data were used for validation of both the diesel-only and the premixed spark-ignition operation regimes. A new formulation of the Characteristic-Timescale combustion model was then introduced to allow smooth transition between the combustion regimes.

Engine experiments and multi-dimensional modeling were used to explore Reactivity Controlled Compression Ignition (RCCI) to realize highly-efficient combustion with near zero levels of NOx and PM. In-cylinder fuel blending using port-fuel-injection of a low reactivity fuel and optimized direct-injection of higher reactivity fuels was used to control combustion phasing and duration. In addition to injection and operating parameters, the study explored the effect of fuel properties by considering both gasoline-diesel dual-fuel operation, ethanol (E85)-diesel dual fuel operation, and a single fuel gasoline-gasoline+DTBP (di-tert butyl peroxide cetane improver). Remarkably, high gross indicated thermal efficiencies were achieved, reaching 59%, 56%, and 57% for E85-diesel, gasoline-diesel, and gasoline-gasoline+DTBP respectively.

A vaporization model for realistic multi-component fuel sprays is described. The equilibrium at the interface between liquid droplets and the surrounding gas is obtained based on the UNIFAC method, which considers non-ideal molecular interactions that can greatly enhance or suppress the vaporization of the components in the system compared to predictions from ideal mixing using Raoult's Law, especially for polar fuels. The present results using the UNIFAC method are shown to be able to capture the azeotropic behaviors of polar molecule blends, such as mixtures of benzene and ethanol, benzene and iso-propanol, and ethanol and water [1]. Predicted distillation curves of mixtures of ethanol and multi-component gasoline surrogates are compared to those from experiments, and the model gives good improvements on predictions of the distillation curves for initial ethanol volume fractions ranging from 0% to 100%.

Premixed compression ignition (PCI) strategies offer the potential for simultaneously low NOx and soot emissions and diesel-like efficiency. However, these strategies are generally confined to low loads due to difficulties controlling the combustion phasing and heat release rate. Recent experiments have demonstrated that dual-fuel reactivity-controlled compression ignition (RCCI) combustion can improve PCI combustion control and expand the PCI load range. Previous studies have explored RCCI operation using port-fuel injection (PFI) of gasoline and direct-injection (DI) of diesel fuel. In this study, experiments are performed using a light-duty, single-cylinder research engine to investigate RCCI combustion using a single fuel with the addition of a cetane improver 2-ethylhexyl nitrate (EHN). The fuel delivery strategy consists of port-fuel injection of E10 (i.e., 10% ethanol in gasoline) and direct-injection of E10 mixed with 3% EHN.

The role of the fluid motion in a diesel engine on mixing and combustion was investigated using the CFD code Kiva-3v. The study considered pre-mixed charge compression ignition (PCCI) combustion that is a hybrid combustion system characterized by early injection timings and high amounts of EGR dilution to delay the start and lower the temperature of combustion. The fuel oxidizer mixture is not homogeneous at the start of combustion and therefore requires further mixing for complete combustion. PCCI combustion systems are characterized by relatively high CO and UHC emissions. This work investigates attenuating CO emissions by enhancing mixing processes through non-uniform flowfield motions. The fluid motion was characterized by the amount of average angular rotation about the cylindrical axis (swirl ratio) and the amount of non-uniform motion imparted by the relative amounts of mass inducted through tangential and helical intake ports in a 0.5L HSDI diesel engine.

In automotive industry it has been a challenge to retain diesel-like thermal efficiency while maintaining low emissions. Numerous studies have shown significant progress in achieving low emissions through the introduction of common-rail injection systems, multiple injections and exhaust gas recirculation and by using a high octane number fuel, like gasoline, to achieve adequate premixing. On the other hand, low temperature combustion strategies, like HCCI and PCCI, have also shown promising results in terms of reducing both NOx and soot emissions simultaneously. With the increasing capacity of computers, multi-dimensional CFD engine modeling enables a reasonably good prediction of combustion characteristics and pollutant emissions, which is the motivation behind the present research. The current research effort presents an optimization study of light-duty compression ignition engine performance, while meeting the emission regulation targets.

A comprehensive biodiesel combustion model is presented for use in multi-dimensional engine simulations. The model incorporates realistic physical properties in a vaporization model developed for multi-component fuel sprays and applies an improved mechanism for biodiesel combustion chemistry. Previously, a detailed mechanism for methyl decanoate and methyl-9-decenoate was reduced from 3299 species to 85 species to represent the components of biodiesel fuel. In this work, a second reduction was performed to further reduce the mechanism to 69 species. Steady and unsteady spray simulations confirmed that the model adequately reproduced liquid penetration observed in biodiesel spray experiments. Additionally, the new model was able to capture expected fuel composition effects with low-volatility components and fuel blend sprays penetrating further.

Sustainable PCI combustion was achieved in a light-duty diesel engine through the installation of a 120° spray angle nozzle and modeling-generated piston bowl geometry developed for compatibility with early start-of-injection timings. Experimental studies were conducted to determine favorable settings for boost pressure, SOI timing, and EGR rate at 2000 rev/min, 5 bar BMEP. An optimal SOI timing was discovered at 43° BTDC where soot and NOx emissions were reduced 89% and 86%, respectively. A 10% increase in fuel consumption was attributed to increased HC and CO emissions as well as non-optimal combustion phasing. Combustion noise was sufficiently attenuated through the use of high EGR rates. The maximum attainable load for PCI combustion was limited by the engine's peak cylinder pressure and cylinder pressure rise rate constraints.

Optimizations were performed on a single-cylinder heavy-duty Caterpillar SCOTE 3401E engine for NOx, PM and BSFC reductions. The engine was equipped with a Caterpillar 300B HEUI fuel injection system capable of up to four injections with timings from 90 BTDC to 90 ATDC. The engine was operated at a medium load (57%), high speed (1737 rev/min) operation point. A micro-genetic algorithm was utilized to optimize a hybrid, double-injection strategy, which incorporated an early, premixed pilot injection with a late main injection. The fuel injection parameters, intake boost pressure, and EGR were considered in the optimization. The optimization produced a parameter set that met the 2007 and 2010 PM emissions mandate of 0.0134 g/kW-hr, and was within the 1.5x not to exceed NOx + HC mandate of 2.694 g/kW-hr. Following the optimization exercise, further parametric interaction studies were performed to reveal the underlying interactions and phenomena.

The heavy-duty diesel engine industry is required to meet stringent emission standards. There is also the demand for more fuel efficient engines by the customer. In a previous study on an engine with variable intake valve closure timing, the authors found that an early single injection and accompanying premixed charge compression ignition (PCCI) combustion provides advantages in emissions and fuel economy; however, unacceptably high peak pressures and rates of pressure-rise impose a severe operating constraint. The use of a Pressure Reactive Piston assembly (PRP) as a means to limit peak pressures is explored in the present work. The concept is applied to a heavy-duty diesel engine and genetic algorithms (GA) are used in conjunction with the multi-dimensional engine simulation code KIVA-3V to provide an optimized set of operating variables.

Optimizations were performed on a Heavy-Duty diesel engine equipped with a conventional electronic unit injector in order to minimize fuel consumption, and emissions of NOx and particulate matter. A low speed light load case and a high speed light load case were optimized with these considerations in mind. Exhaustive parametric studies were performed in order to find sets of operating conditions that resulted in low emissions and high fuel economy. It was found for the low speed light load case (Mode 2, 25% load and 821 rev/min) that low emissions operating conditions existed at either very early or very late start-of-injection timings and high EGR (PM = 0.018 g/kW-hr, NOx + HC = 1.493 g/kW-hr with SOI = -21 degrees ATDC, 48% EGR; or 0.085 g/kW-hr PM, 1.02 g/kW-hr NOx with SOI = 4 degrees ATDC, 39% EGR).

To overcome the trade-off between NOx and particulate emissions for future diesel vehicles and engines it is necessary to seek methods to lower pollutant emissions. The desired simultaneous improvement in fuel efficiency for future DI (Direct Injection) diesels is also a difficult challenge due to the combustion modifications that will be required to meet the exhaust emission mandates. This study demonstrates the emission reduction capability of split injections, EGR (Exhaust Gas Recirculation), and other parameters on a High Speed Direct Injection (HSDI) diesel engine equipped with a common rail injection system using an RSM (Response Surface Method) optimization method. The optimizations were conducted at 1757 rev/min, 45% load. Six factors were considered for the optimization, namely the EGR rate, SOI (Start of Injection), intake boost pressure, and injection pressure, the percentage of fuel in the first injection, and the dwell between injections.

Current automotive diesel engine research is motivated by the need to meet more-and-more strict emission regulations. The major target for future HSDI combustion research and development is to find the most effective ways of reducing the soot particulate and NOx emissions to the levels required by future emission regulations. Recently, a variety of statistical optimization tools have been proposed to optimize engine-operating conditions for emissions reduction. In this study, a micro-genetic algorithm technique, which locates a global optimum via the law of “the survival of the fittest”, was applied to a high-speed, direct-injection, single-cylinder (HSDI) diesel engine. The engine operating condition considered single-injection operation using a common-rail fuel injection system was at 1757 rev/min and 45% load.

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.

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.

An emissions and performance study was conducted to explore the effects of exhaust gas recirculation (EGR) and multiple injections on the emission of oxides of nitrogen (NOx), particulate emissions, and brake specific fuel consumption (BSFC) over a wide range of engine operating conditions. The tests were conducted on an instrumented single cylinder version of the Caterpillar 3400 series heavy duty Diesel engine. Data was taken at 1600 rev/min, and 75% load, and also at operating conditions taken from a 6-mode simulation of the federal transient test procedure (FTP). The fuel system used was an electronically controlled, common rail injector and supporting hardware. The fuel system was capable of as many as four independent injections per combustion event at pressures from 20 to 120MPa.

Studies on the effects of methyl soyate (biodiesel) blends with #2 diesel fuel in conjunction with various high pressure injection schemes were conducted on a single cylinder version of the Caterpillar 3400 series heavy duty diesel engine. Engine operating conditions at both high and low loads were investigated. Experiments were performed over a range of injection timings allowing particulate versus NOx trade-off curves to be generated. Phillips 66 certified #2 diesel fuel was used as the baseline; mixtures of 20% and 40% by volume of methyl soyate with the baseline fuel were used as the biodiesel blends. A blend of 20% by volume octadecene (a hydrocarbon fuel that is representative of the biodiesel hydrocarbon's composition but without the oxygen) in #2 diesel fuel was also investigated to help determine the mechanisms of emissions reduction.

A, three-dimensional CFD code, based on the KIVA code, is used to explore alternatives to conventional DI diesel engine designs for reducing NOx and soot emissions without sacrificing engine performance. The effects of combustion chamber design and fuel spray orientation are investigated using a new proposed GAMMA engine concept, and two new multiple injector combustion system (MICS) designs which utilize multiple injectors to increase gas motion and enhance fuel/air mixing in the combustion chamber. From these computational studies, it is found that both soot and nitrous oxide emissions can be significantly reduced without the need for more conventional emission control strategies such as EGR or ultra high injection pressure. The results suggest that CFD models can be a useful tool not only for understanding combustion and emissions production, but also for investigating new design concepts.

The paper presents the development of a novel approach to the solution of detailed chemistry in internal combustion engine simulations, which relies on the analytical computation of the ordinary differential equations (ODE) system Jacobian matrix in sparse form. Arbitrary reaction behaviors in either Arrhenius, third-body or fall-off formulations can be considered, and thermodynamic gas-phase mixture properties are evaluated according to the well-established 7-coefficient JANAF polynomial form. The current work presents a full validation of the new chemistry solver when coupled to the KIVA-4 code, through modeling of a single cylinder Caterpillar 3401 heavy-duty engine, running in two-stage combustion mode.