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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%.

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.

The present study attempted to model experimental results obtained on an optical engine at the Sandia National Laboratory. Measurements of in-cylinder unburned hydrocarbon (UHC) distributions were provided using advanced optical diagnostics on a near production type piston. Previous multidimensional modeling provided accurate pressure profiles and heat release rate (HRR) predictions. However, the experimental UHC distribution was not matched, and the model predicted UHC extending from the bowl into the squish region in the expansion stroke. To explore the causes of this discrepancy a parametric study was performed using a variety of initial conditions, boundary conditions and model constants to explore their effects on the UHC distribution. Of the initial conditions, the swirl ratio was found to have the biggest impact on the UHC distribution.

In-cylinder fuel blending of gasoline with diesel fuel is investigated on a multi-cylinder light-duty diesel engine as a strategy to control in-cylinder fuel reactivity for improved efficiency and lowest possible emissions. This approach was developed and demonstrated at the University of Wisconsin through modeling and single-cylinder engine experiments. The objective of this study is to better understand the potential and challenges of this method on a multi-cylinder engine. More specifically, the effect of cylinder-to-cylinder imbalances and in-cylinder charge motion as well as the potential limitations imposed by real-world turbo-machinery were investigated on a 1.9-liter four-cylinder engine. This investigation focused on one engine condition, 2300 rpm, 5.5 bar net mean effective pressure (NMEP). Gasoline was introduced with a port-fuel-injection system.

This study investigates the potential of controlling premixed charge compression ignition (PCCI) combustion strategies by varying fuel reactivity. In-cylinder fuel blending using port fuel injection of gasoline and early cycle, direct-injection of diesel fuel was used for combustion phasing control at a medium engine load of 9 bar net IMEP and was also found to be effective to prevent excessive rates of pressure rise. Parameters used in the experiments were guided from the KIVA-CHEMKIN code with a reduced primary reference fuel (PRF) mechanism including injection timings, fuel percentages, and intake valve closing (IVC) timings for dual-fuel PCCI combustion. The engine experiments were conducted with a conventional common rail injector (i.e., wide angle and large nozzle hole) and demonstrated control and versatility of dual-fuel PCCI combustion with the proper fuel blend, SOI and IVC timings.

The ignition process of fuel reactivity controlled PCCI combustion was investigated using engine experiments and detailed CFD modeling. The experiments were performed using a modified all metal heavy-duty, compression-ignition engine. The engine was fueled using commercially available gasoline (PON 91.6) and ULSD diesel delivered through separate port and direct injection systems, respectively. Experiments were conducted at a steady state-engine load of 4.5 bar IMEP and speed of 1300 rev/min. In-cylinder optical measurements focused on understanding the fuel decomposition and fuel reactivity stratification provided through the charge preparation. The measurement technique utilized point location optical access through a modified cylinder head with two access points in the firedeck. Optical measurements of natural thermal emission were performed with an FTIR operating in the 2-4.5 μm spectral region.

Homogeneous-charge, compression-ignition (HCCI) combustion is triggered by spontaneous ignition in dilute homogeneous mixtures. The combustion rate must be reduced by suitable solutions such as high rates of Exhaust Gas Recirculation (EGR) and/or lean mixtures. HCCI is considered a very effective way to reduce engine pollutant emissions, however only a few HCCI engines have entered into production. HCCI combustion currently cannot be extended to the whole engine operating range, especially to high loads, since the use of EGR displaces air from the cylinder, limiting engine mean effective pressure, thus the engine must be able to operate also in conventional mode. This paper concerns a study of an innovative concept to control HCCI combustion in diesel-fuelled engines. The concept consists in forming a pre-compressed homogeneous charge outside the cylinder and gradually admitting it into the cylinder during the combustion process.

An experimental study was conducted on an air cooled high-speed, direct-injection diesel generator that investigated the use of gasoline in a dual fuel PCCI strategy. The single-speed generator used in the study has an effective compression ratio of 17 and runs at 3600 rev/min. Varying amounts of gasoline were introduced into the combustion chamber through a port injection system. The generator uses an all-mechanical diesel fuel injection system that has a fixed injection timing. The experiments explored variable intake temperatures and fuel split quantities to investigate different combustion phasing regimes. Results from the study showed low combustion efficiency at low load. Low load operation was also characterized by high levels of HC and CO (in excess of 20 g/kwh and 50 g/kwh respectively). Operation at 75% load was more efficient, and displayed three different combustion regimes that are possible with PIG (port injected gasoline) dual fuel PCCI.

The objective of this investigation is to optimize a light-duty diesel engine in order to minimize soot, NOx, carbon monoxide (CO), unburned hydrocarbon (UHC) emissions and peak pressure rise rate (PPRR) while improving fuel economy in a low oxygen environment. Variables considered are the injection timings, fractional amount of fuel per injection, half included spray angle, swirl, and stepped-bowl piston geometry. The KIVA-CHEMKIN code, a multi-dimensional computational fluid dynamics (CFD) program with detailed chemistry is used and is coupled to a multi-objective genetic algorithm (MOGA) along with an automated grid generator. The stepped-piston bowl allows more options for spray targeting and improved charge preparation. Results show that optimal combinations of the above variables exist to simultaneously reduce emissions and fuel consumption. Details of the spray targeting were found to have a major impact on the combustion process.

A numerical study was performed to compare the formation of nitric oxide (NO) and nitrogen dioxide (NO₂), collectively termed NOx, resulting from biodiesel and diesel combustion in an internal combustion engine. It has been shown that biodiesel tends to increase NOx compared to diesel, and to-date, there is no widely accepted explanation. Many factors can lead to increased NOx formation and it was of interest to determine if fuel chemistry plays a significant role. Therefore, in order to isolate the fuel chemistry from mixing processes typical in a compression ignition engine, sprays were not considered in the present investigation. The current study compares the NOx formation of surrogates for biodiesel (as represented by methyl butanoate and n-heptane) and diesel (n-heptane) under completely homogeneous conditions. Combustion of each fuel was simulated using the Senkin code for both an adiabatic, constant volume reactor, and an adiabatic, single-zone HCCI engine model.

This study investigates the potential of controlling premixed charge compression ignition (PCCI and HCCI) combustion strategies by varying fuel reactivity. In-cylinder fuel blending using port fuel injection of gasoline and early cycle direct injection of diesel fuel was used for combustion phasing control at both high and low engine loads and was also effective to control the rate of pressure rise. The first part of the study used the KIVA-CHEMKIN code and a reduced primary reference fuel (PRF) mechanism to suggest optimized fuel blends and EGR combinations for HCCI operation at two engine loads (6 and 11 bar net IMEP). It was found that the minimum fuel consumption could not be achieved using either neat diesel fuel or neat gasoline alone, and that the optimal fuel reactivity required decreased with increasing load. For example, at 11 bar net IMEP, the optimum fuel blend and EGR rate for HCCI operation was found to be PRF 80 and 50%, respectively.

The effects of spray targeting on mixing, combustion, and pollutant formation under a low-load, late-injection, low-temperature combustion (LTC) diesel operating condition are investigated by optical engine measurements and multi-dimensional modeling. Three common spray-targeting strategies are examined: conventional piston-bowl-wall targeting (152° included angle); narrow-angle floor targeting (124° included angle); and wide-angle piston-bowl-lip targeting (160° included angle). Planar laser-induced fluorescence diagnostics in a heavy-duty direct-injection optical diesel engine provide two-dimensional images of fuel-vapor, low-temperature ignition (H2CO), high-temperature ignition (OH) and soot-formation species (PAH) to characterize the LTC combustion process.

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.

The goal of this research is to investigate the physical parameters of stoichiometric operation of a diesel engine under a light load operating condition (6∼7 bar IMEP). This paper focuses on improving the fuel efficiency of stoichiometric operation, for which a fuel consumption penalty relative to standard diesel combustion was found to be 7% from a previous study. The objective is to keep NOx and soot emissions at reasonable levels such that a 3-way catalyst and DPF can be used in an aftertreatment combination to meet 2010 emissions regulation. The effects of intake conditions and the use of group-hole injector nozzles (GHN) on fuel consumption of stoichiometric diesel operation were investigated. Throttled intake conditions exhibited about a 30% fuel penalty compared to the best fuel economy case of high boost/EGR intake conditions. The higher CO emissions of throttled intake cases lead to the poor fuel economy.

Sources of unburned hydrocarbon (UHC) emissions are examined for a highly dilute (10% oxygen concentration), moderately boosted (1.5 bar), low load (3.0 bar IMEP) operating condition in a single-cylinder, light-duty, optically accessible diesel engine undergoing partially-premixed low-temperature combustion (LTC). The evolution of the in-cylinder spatial distribution of UHC is observed throughout the combustion event through measurement of liquid fuel distributions via elastic light scattering, vapor and liquid fuel distributions via laser-induced fluorescence, and velocity fields via particle image velocimetry (PIV). The measurements are complemented by and contrasted with the predictions of multi-dimensional simulations employing a realistic, though reduced, chemical mechanism to describe the combustion process.

Homogeneous Charge Compression Ignition (HCCI) has been shown as a promising technique for simultaneous NOx and soot reduction while maintaining diesel-like efficiency. Although HCCI has been shown to yield very low emissions levels, spray-wall impingement and high pressure rise rates can be problematic due to the early injection timings necessary for certain HCCI operations. To address spray-wall impingement, an Adaptive Injection Strategy (AIS) was employed. This strategy uses multiple pulses at both low and high injection pressures to prepare an optimal in-cylinder mixture. A unique Variable Pressure Pulse (VPP) was developed to investigate the AIS concept experimentally. The VPP has the capability of delivering multiple injections at both low and high injection pressures (∼100 bar and ∼1000 bar respectively) through a single injector in the same engine cycle. Comparisons were made between model predictions and engine experiments using the VPP system.

This paper concerns a study of an innovative concept to control HCCI combustion in diesel-fueled engines. The concept consists in forming a pre-compressed homogeneous charge outside the cylinder and in gradually admitting it into the cylinder during the combustion process. This new combustion concept has been called Homogeneous Charge Progressive Combustion (HCPC). CFD analysis was conducted to understand the feasibility of the HCPC concept and to identify the parameters that control and influence this novel HCCI combustion. A CFD code with detailed kinetic chemistry (AVL FIRE) was used in the study. Results in terms of pressure, heat release rate, temperature, and emissions production are presented that demonstrate the validity of the HCPC combustion concept.

A study of partially premixed combustion (PPC) with non-oxygenated 91 pump octane number1 (PON) commercially available gasoline was performed using a heavy-duty (HD) compression-ignition (CI) 2.44 l Caterpillar 3401E single-cylinder oil test engine (SCOTE). The experimental conditions selected were a net indicated mean effective pressure (IMEP) of 11.5 bar, an engine speed of 1300 rev/min, an intake temperature of 40°C with intake and exhaust pressures of 200 and 207 kPa, respectively. The baseline case for all studies presented had 0% exhaust gas recirculation (EGR), used a dual injection strategy a -137 deg ATDC pilot SOI and a -6 deg ATDC main start-of-injection (SOI) timing with a 30/70% pilot/main fuel split for a total of 5.3 kg/h fueling (equating to approximately 50% load). Combustion and emissions characteristics were explored relative to the baseline case by sweeping main and pilot SOI timings, injection split fuel percentage, intake pressure, load and EGR levels.

The development of a new Nitric Oxide (NOx) reaction mechanism has been conducted by adding species, including hydrogen cyanide (HCN) and the CH radical to a reduced chemistry diesel combustion model. The additional chemical reactions were added to the ERC's reduced 12-step NOx mechanism, which consists of N, NO, N2O, and NO2. The new NOx mechanism was implemented into the KIVA/ERC-CHEMKIN code and was found to be able to predict the experimentally observed trend that the amount of engine-out NOx decreases as engine load is increased, which is not reproduced by the current reduced NOx mechanism. HCN and CH were found to be species that bridge CxHy products and N radicals via the reaction CH+N2→HCN+N under high equivalence ratio conditions, and Zeldovich NO formation is suppressed by the formation of HCN, a species in the Fenimore NO formation pathway. The additional species and reactions were also found to influence the prediction of engine-out soot emissions.

Improvements to combustion models for modeling spark ignition engines using the G-equation flame propagation model and detailed chemical kinetics have been performed. The improvements include revision of a PRF chemistry mechanism, precise calculation of “primary heat release” based on the sub-grid scale unburned/burnt volumes of flame-containing cells, modeling flame front quenching in highly stratified mixtures, introduction of a Damkohler model for assessing the combustion regime of flame-containing cells, and a better method of modeling the effects of the local residual value on the burning velocity. The validation of the revised PRF mechanism shows that the calculated ignition delay matches shock tube data very well. The improvements to the “primary heat release” model based on the cell unburned/burnt volumes more precisely consider the chemical kinetics heat release in unburned regions, and thus are thought to be physically reasonable.