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The basic idea behind large-eddy simulation (LES) is to accurately resolve the large energy-containing scales and to use subgrid-scale (SGS) models for the smaller scales. The accuracy of LES can be significantly impacted by the numerical discretization schemes and the choice of the SGS model. This work investigates the accuracy of low-order LES codes in the simulation of a turbulent round jet which is representative of fuel jets in engines. The turbulent jet studied is isothermal with a Reynolds number of 6800. It is simulated using Converge, which is second-order accurate in space and first-order in time, and FLEDS, developed at Purdue University, which is sixth-order accurate in space and fourth-order in time. The high-order code requires the resolution of acoustic time-scales and hence is approximately 10 times more expensive than the low-order code.

Hydrogen is widely considered a promising fuel for future transportation applications for both, internal combustion engines and fuel cells. Due to their advanced stage of development and immediate availability hydrogen combustion engines could act as a bridging technology towards a wide-spread hydrogen infrastructure. Although fuel cell vehicles are expected to surpass hydrogen combustion engine vehicles in terms of efficiency, the difference in efficiency might not be as significant as widely anticipated [1]. Hydrogen combustion engines have been shown capable of achieving efficiencies of up to 45 % [2]. One of the remaining challenges is the reduction of nitric oxide emissions while achieving peak engine efficiencies. This paper summarizes research work performed on a single-cylinder hydrogen direct injection engine at Argonne National Laboratory.

Gasoline-ethanol-methanol (GEM) blends, with constant stoichiometric air-to-fuel ratio (iso-stoichiometric blending rule) and equivalent to binary gasoline-ethanol blends (E2, E5, E10 and E15 in % vol.), were defined to investigate the effect of methanol and combined mixtures of ethanol and methanol when blended with three FACE (Fuels for Advanced Combustion Engines) Gasolines, I, J and A corresponding to RON 70.2, 73.8 and 83.9, respectively, and their corresponding Primary Reference Fuels (PRFs). A Cooperative Fuel Research (CFR) engine was used under Spark Ignition and Homogeneous Charge Compression Ignited modes. An ignition quality tester was utilized in the Compression Ignition mode. One of the promising properties of GEM blends, which are derived using the iso-stoichiometric blending rule, is that they maintain a constant octane number, which has led to the introduction of methanol as a drop-in fuel to supplement bio-derived ethanol.

The increasing demand for high-octane fuels is pushing the combustion research towards investigating new potential fuels and octane boosters. In addition to their high-octane, those additives should be environmentally friendly. In this study, the anti-knock properties of Dicyclopentadiene (DCPD) as an additive to primary reference fuels (PRF) and toluene primary reference fuels (TPRF) have been investigated. The Research octane number (RON) and Motor octane number (MON) were measured using Cooperative Fuels Research (CFR) engine for four different fuel blends; PRF 60 + 10% DCPD, PRF 60 + 20% DCPD, PRF 70 + 10% DCPD and TPRF 70 + 10% DCPD. In addition, homogenous charge compression ignition (HCCI) was also performed using the CFR engine to show the effect of DCPD on suppressing low temperature chemistry of reference fuels.

Building a vehicle model with sufficient accuracy for fuel economy analysis is a time-consuming process, even with the modern-day simulation tools. Obtaining the right kind of data for modeling a vehicle can itself be challenging, given that while OEMs advertise the power and torque capability of their engines, the efficiency data for the components or the control algorithms are not usually made available for independent verification. The U.S. Department of Energy (DOE) funds the testing of vehicles at Argonne National Laboratory, and the test data are publicly available. Argonne is also the premier DOE laboratory for the modeling and simulation of vehicles. By combining the resources and expertise with available data, a process has been created to automatically develop a model for any conventional vehicle that is tested at Argonne. This paper explains the process of analyzing the publicly available test data and computing the parameters of various components from the analysis.

Alternative electric motor geometry with potentially increased efficiency is being considered for hybrid electric vehicle applications. An axial flux motor with a dynamically adjustable air gap (i.e., mechanical field weakening) has been tested, analyzed, and modeled for use in a vehicle simulation tool at Argonne National Laboratory. The advantage of adjusting the flux is that the motor torque-speed characteristics can better match the vehicle load. The challenge in implementing an electric machine with these qualities is to develop a control strategy that takes advantage of the available efficiency improvements without using excessive energy to mechanically adjust the air gap and thus reduce the potential energy savings. Motor efficiency was mapped in terms of speed, torque, supply voltage, and rotor-to-stator air gap.

The bitterant denatonium benzoate is being used in automotive coolants to deter human ingestion. The environmental impact of large scale use of bitterants has not been reported. Studies on the biodegradability of denatonium benzoate suggest that the benzoate is primarily responsible for the reported biodegradation. Since the aversive taste is associated with the denatonium ion, denatonium chloride was investigated in the Semi-Continuous Activated Sludge (SCAS) Test and the modified Sturm CO2 Production Test to determine if the denatonium ion would persist in the effluent after biological wastewater treatment. A microbial inhibition test demonstrated that the material is not toxic to the microorganisms in activated sludge between the concentrations of 1 and 150 mg active/L. The denatonium ion was not removed by microbial degradation or by adsorption onto the sludge solids in the SCAS test. The lack of CO2 production corroborated the lack of biodegradation observed in the SCAS test.

The effect of ethanol blended with three FACE (Fuels for Advanced Combustion Engines) gasolines, I, J and A corresponding to RON 70.3, 71.8 and 83.5, respectively, were compared to PRF70 and PRF84 with the same ethanol concentrations, these being 2%, 5%, 10%, 15% and 20% by volume. A Cooperative Fuel Research (CFR) engine was used to understand the blending effect of ethanol with FACE gasolines and PRFs in spark-ignited and homogeneous charge compression ignited mode. Blending octane numbers (BON) were obtained for both the modes. All the fuels were also tested in an ignition quality tester to obtain Blending Derived Cetane numbers (BDCN). It is shown that fuel composition and octane number are important characteristics of all the base fuels that have a significant impact on octane increase with ethanol. The dependency of octane number for the base fuel on the blending octane number depended on the combustion mode operated.

The blending behavior of ethanol in five different hydrocarbon base fuels with octane numbers of approximately 70 and 84 was examined under Spark-Ignited (SI) and Homogeneous Charge Compression Ignited (HCCI) operating conditions. The Blending octane number (BON) was used to characterize the blending behavior on both a volume and molar basis. Previous studies have shown that the blending behavior of ethanol generally follows several well-established rules. In particular, non-linear blending effects are generally observed on a volume basis (i.e. BON > RON or MON of pure ethanol; 108 and 89, respectively), while linear blending effects are generally observed on a molar basis (i.e. BON = RON or MON of pure ethanol). This work firstly demonstrates that the non-linear volumetric blending effects traditionally observed under SI operating conditions are also observed under HCCI operating conditions.

The U.S. Department of Energy (DOE) Office of Advanced Automotive Technologies (OAAT), in partnership with industry, is developing transportation technologies that will improve the energy efficiency of our transportation system. Most OAAT programs are focused exclusively on technology development. However, the twin goals of developing innovative technologies and transferring them to industry led OAAT to realize the growing need for people trained in non-traditional, emerging technologies. The Graduate Automotive Technology Education (GATE) program combines graduate-level education with technology development and transfer by training a new generation of automotive engineers in critical multi-disciplinary technologies, by fostering cooperative research in those technologies, and by transferring those technologies directly to industrial organizations.

This study presents experimental and numerical examination of directly injected (DI) propane and iso-octane, surrogates for liquified petroleum gas (LPG) and gasoline, respectively, at various engine like conditions with the overall objective to establish the baseline with regards to fuel delivery required for future high efficiency DI-LPG fueled heavy-duty engines. Sprays for both iso-octane and propane were characterized and the results from the optical diagnostic techniques including high-speed Schlieren and planar Mie scattering imaging were applied to differentiate the liquid-phase regions and the bulk spray phenomenon from single plume behaviors. The experimental results, coupled with high-fidelity internal nozzle-flow simulations were then used to define best practices in CFD Lagrangian spray models.

Blending gasoline with oxygenates like ethanol, MTBE or ETBE has a proven potential to increase the thermodynamic efficiency by enhancing knock resistance. The present research focuses on assessing the capability of a 2- and tert-butanol mixture as a possible alternative to state-of-the-art oxygenates. The butanol mixture was blended into a non-oxygenated reference gasoline with a research octane number (RON) of 97. The butanol blending ratios were 15% and 30% by mass. Both the thermodynamic potential and the impact on emissions were investigated. Tests are performed on a highly boosted single-cylinder gasoline engine with high load capability and a direct injecting fuel system using a solenoid-actuated multi-hole injector. The engine is equipped with both intake and exhaust cam phasers. The engine has been chosen for the fuel investigation, as it represents the SI technology with a strongly increasing market share.

A computational fluid dynamics (CFD) guided combustion system optimization was conducted for a heavy-duty diesel engine running with a gasoline fuel that has a research octane number (RON) of 80. The goal was to optimize the gasoline compression ignition (GCI) combustion recipe (piston bowl geometry, injector spray pattern, in-cylinder swirl motion, and thermal boundary conditions) for improved fuel efficiency while maintaining engine-out NOx within a 1-1.5 g/kW-hr window. The numerical model was developed using the multi-dimensional CFD software CONVERGE. A two-stage design of experiments (DoE) approach was employed with the first stage focusing on the piston bowl shape optimization and the second addressing refinement of the combustion recipe. For optimizing the piston bowl geometry, a software tool, CAESES, was utilized to automatically perturb key bowl design parameters. This led to the generation of 256 combustion chamber designs evaluated at several engine operating conditions.

A computational fluid dynamics (CFD) guided combustion system optimization was conducted for a heavy-duty compression-ignition engine with a gasoline-like fuel that has an anti-knock index (AKI) of 58. The primary goal was to design an optimized combustion system utilizing the high volatility and low sooting tendency of the fuel for improved fuel efficiency with minimal hardware modifications to the engine. The CFD model predictions were first validated against experimental results generated using the stock engine hardware. A comprehensive design of experiments (DoE) study was performed at different operating conditions on a world-leading supercomputer, MIRA at Argonne National Laboratory, to accelerate the development of an optimized fuel-efficiency focused design while maintaining the engine-out NOx and soot emissions levels of the baseline production engine.

Gasoline is a complex fuel. Many of the constituents of gasoline that are beneficial for the internal combustion engine (ICE) are expected to be challenging for on-board reformers in fuel-cell vehicles. To address these issues, the autothermal reforming of gasoline and individual components of gasoline has been investigated. The results indicate that aromatic components require higher temperatures and longer contact times to reform than paraffinic components. Napthenic components require higher temperatures to reform, but can be reformed at higher space velocities than paraffinic components. The effects of sulfur are dependent on the catalyst. These results suggest that further evolution of gasoline could reduce the demands on the reformer and provide a better fuel for a fuel-cell vehicle.

In a regulatory environment for spark ignition (SI) engines where the focus is continuously looking into improvements in fuel economy and reduction in noxious emissions, the challenges to achieve future requirements are utmost. To effectively reduce CO2 emissions on a well-to-wheel basis, future fuels enabling high efficiency SI engines will have to not only satisfy advanced engine requirements, i.e. high knock resistance, but also produce less CO2 emissions in the refinery. This paper describes how to characterize SI combustion's on-demand octane requirement with three different dual fuel configurations. Refinery naphtha was used for low octane component, and three oxygenates were used for high octane knock inhibiting component, such as, Methanol and Methyl tert-butyl ether (MTBE) and Ethyl tert-butyl ether (ETBE). Each low and high octane fuel was introduced via production gasoline direct injector (DI) and port fuel injector (PFI) in both configurations.

At the current stage of engine technology, diesel engines typically require diesel particulate filter (DPF) systems to meet recent particulate emissions standards. To assure the performance and reliability of DPF systems, profound understanding of filtration and regeneration mechanisms is required. Among extensive efforts for developing advanced DPF systems, the development of effective thermal management strategies, which control the thermal runaway taking place in oxidation of an excess amount of soot deposit in DPF, is quite challenging. This difficulty stems mainly from lack of sufficient knowledge and understanding about DPF regeneration mechanisms, which need detailed information about oxidation of diesel particulate matter (PM). Therefore, this work carried out a series of oxidation experiments of diesel particulates collected from a DPF on a diesel engine, and evaluated the oxidation rates of the samples using a thermo-gravimetric analyzer (TGA).

Detailed characteristics of morphology, nanostructures, and sizes were analyzed for particulate matter (PM) emissions from low-temperature combustion (LTC) modes of a single-cylinder, light-duty diesel engine. The LTC engines have been widely studied in an effort to achieve high combustion efficiency and low exhaust emissions. Recent reports indicate that the number of nucleation mode particles increased in a broad engine operating range, which implies a negative impact on future PM emissions regulations in terms of the nanoparticle number. However, the size measurement of solid carbon particles by commercial instruments is indeed controversial due to the contribution of volatile organics to small nanoparticles. In this work, an LTC engine was operated with various biofuel blends, such as blends (B20) of soy bean oil (soy methyl ester, SME20) and palm oil (palm methyl ester, PME20), as well as an ultra-low-sulfur diesel fuel.

It is well know that the internal flow field and nozzle geometry affected the spray behavior, but without high-speed microscopic visualization, it is difficult to characterize the spray structure in details. Single-hole diesel injectors have been used in fundamental spray research, while most direct-injection engines use multi-hole nozzle to tailor to the combustion chamber geometry. Recent engine trends also use smaller orifice and higher injection pressure. This paper discussed the quasi-steady near-nozzle diesel spray structures of an axisymmetric single-hole nozzle and a symmetric two-hole nozzle configuration, with a nominal nozzle size of 130 μm, and an attempt to correlate the observed structure to the internal flow structure using computational fluid dynamic (CFD) simulation. The test conditions include variation of injection pressure from 30 to 100 MPa, using both diesel and biodiesel fuels, under atmospheric condition.

In Diesel engines, fuel injection plays a critical role in performance, efficiency, and emissions. Altering parameters such as injection quantity, duration, pressure, etc. influences the injector's performance. Changes in the injection system architecture can also affect the spray behavior. Understanding of the flow near the nozzle exit can lead to the establishment of correlation to spray characteristics further downstream, and eventually its combustion behavior in the engine. Because of its high density, the near-nozzle region of the spray is difficult to study using optical techniques. This near-nozzle region of spray from high pressure injectors was studied using the quantitative and time-resolved x-ray radiography technique. This method provides high spatial and temporal resolution without significant scattering effects.