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Computational Fluid Dynamics (CFD) simulation is widely used in the development and validation of automotive engine performance. In engine simulation, spray breakup submodels are important because spray atomization has a significant influence on mixture formation and the combustion process. However, no breakup models have been developed for the fuel spray with plate-type multi-hole nozzle installed in port fuel injection spark ignition (SI) engines. Therefore, the purpose of this study is to simulate spray formation in port fuel injection precisely. The authors proposed the heterogeneous sheet breakup model for gasoline spray injected from plate type multi-hole nozzle. The novel breakup model was developed by clarifying the phenomenological mechanism of the spray atomization process. In this paper, this model was improved in dispersion characteristics and evaluated by the comparison of the model calculation results with experimental data.

In this study, the authors analyze the concentration distribution of an evaporative spray mixture with LIEF (Laser induced exciplex fluorescence) method, which is a type of optical measurement. LIEF method is one of the optical measurements for obtaining the spray concentration distribution for separating vapor/liquid phases based on the fluorescence characteristics. In this paper, a quantitative concentration distribution analysis method for wall impingement spray in heterogeneous temperature field has been proposed. Then, a series of experiments were performed in varying injection pressure and ambient density. As a result, a two-dimensional concentration distribution was obtained for the free spray and wall impingement spray.

Research on alternative fuels is necessary to reduce CO2 emissions. Hydrotreated Vegetable Oil (HVO) of light fuel physically improves spray and combustion characteristics. Fatty Acid Methyl Ester (FAME) is an oxygenated fuel and its combustion characteristics are chemically improved, although its spray characteristics such as penetration and atomization are deteriorated. The purpose of this study is to understand the effects of blending HVO, which has carbon neutral (CN) characteristics, with FAME, which also has CN characteristics, on spray and combustion characteristics, and to further improve emission such as THC and Smoke. This report presents the effect of the combination of improved spray characteristics and oxygenated fuel on emissions. Spray characteristics such as penetration, spray angle and spray volume were investigated by shadowgraph photography.

Fuel design concept has been proposed for low emission and combustion control in engine systems. In this concept, the multicomponent fuels, which are mixed with a high volatility fuel (gasoline or gaseous fuel components) and a low volatility fuel (gas oil or fuel oil components), are used for artificial control of fuel properties. In addition, these multicomponent fuels can easily lead to flash boiling which promote atomization and vaporization in the spray process. In order to understand atomization and vaporization process of multicomponent fuels in detail, the model for flash boiling spray of multicomponent fuel have been constructed and implemented into KIVA3V rel.2. This model considers the detailed physical properties and evaporation process of multicomponent fuel and the bubble nucleation, growth and disruption in a nozzle orifice and injected fuel droplets.

Bio-hydro fined diesel (BHD) oil is known as a second generation oil made from bio hydro finning process. Biodiesel in the first generation is made from transesterification process and it has several disadvantages such as high density and increased the viscosity that can cause operational problems because can make some deposits in the engine. To overcome this, the second generation process of biodiesel has been modified from the first generation oil. BHD is made from the waste cooking oil by using the hydro finning process without the trans-esterification process. The results of BHD oil has nearly the same with diesel oil. BHD oil has low viscosity and high oxidation stability. Therefore, BHD oil can be used in the diesel engine without making any modifications in the engine. In this study, the comparison of performance and emissions characteristics from BHD oil, waste cooking oil, and diesel oil are investigated.

The purpose of this study is to achieve thermal efficiency improvement and cooling loss reduction of a diesel engine with a combustion concept of earlier evaporation, higher entrainment, and compact spray flame. In order to realize this concept, the paper focused on two-component fuel (nC5H12/nC10H22) with high evaporation. In this paper, the effects of two-component fuel on thermal efficiency and exhaust characteristics are examined by using single cylinder diesel engine. In addition, spray characteristics are revealed in an optically accessible chamber and combustion characteristics are revealed by using RCEM.

The flash boiling by fuel heating is a useful method to control the time spatial spray characteristics such as atomization of droplets, vaporization and air-fuel mixture concentration. It is one of the important phenomena for a direct injection gasoline engine (D.I.S.I) as a next generation powertrain. This report focuses on flash boiling spray using fuel heating. The purpose of this study is to understand its physical phenomena with scattered light method, schlieren photography, and Super High Spatial Resolution Photography (SHSRP). Fuel is iso-octane and injectors are a single hole nozzle and a multi hole nozzle. These are used for the basic phenomenon analysis. The influence on spray shape can be shown by schlieren photography. Spray droplet diameter and spray dispersion at the nozzle exit are observed by super high spatial resolution photography that is our original development technique. This is the first time that this SHSRP is applied to the measurement of the heating spray.

To execute the computational fluid dynamics coupling with fuel chemistry in internal combustion engines, simplified chemical kinetic models which capture the low-temperature oxidation kinetics would be required. A steady-state analysis was applied to see the complicated reaction mechanism of alkylperoxy radicals by assuming the steady state for hydroperoxyalkyl (QOOH) and hydroperoxyalkylperoxy (OOQOOH) radicals. This analysis clearly shows the systematic trend of the reaction rate for the chain-branching and non-branching process of alkylperoxy (ROO) radicals as a function of the chain length and the carbon class. These trends make it possible to classify alkylperoxy radicals by their chemical structures, and suggest a reduced low-temperature oxidation chemistry.

The atomization structure of the fuel spray is known to be affected by flow conditions and cavitation inside the nozzle hole. In this paper, the cavitation phenomena inside the nozzle hole was visualized by using large-scale transparent nozzles, as well as the effect of length-to-width ratio (l/w ratio) of the nozzle hole on cavitation and on the behavior of injection liquid jet. In addition, various flow patterns inside the nozzle hole same as experimental conditions were simulated by the use of Cavitation model incorporated in Star-CCM+, which was compared with experimental results.

One of the authors has proposed to use the decay rate of EHRR, the effective heat release rate, d2Q/dθ2 as an index for the rapid local combustion [1]. In this study, EHRR profiles and the cylinder gas pressure oscillations of the low and high speed knock are analyzed by using this index. A delayed rapid local combustion, such as an autoignition with small burned mass fraction can be detected. In the cases of the low speed knock, it has been agreed that a rapid local combustion is an autoignition. Although whether the cylinder gas oscillation is provoked by an auto ignition in a certain cycle or not is an irregular phenomenon, the auto ignition takes place in almost all of the cycles in the knocking condition. Mixture mass fraction burned by an auto ignition is large. A small auto ignition may induce a secondary auto ignition, in many cases, mass burned by the secondary auto ignition is extremely large.

The compressible Large-Eddy Simulation (LES) for the diesel spray with OpenFOAM is presented to reduce CPU time by massively parallel computing of the scalar type supercomputer (CRAY XE6) and simulate the development of the non-evaporative and the evaporative spray. The maximum computational speeds are 14 times (128 cores) and 43 times (128 cores) for of the non-evaporative spray and the spray flame with one-step reaction, respectively, compared to the one core simulation. In the spray flame simulation with the reduced reaction mechanism (29 species, 52 reactions), the maximum computational speed is 149 times (512 cores). Then LES of the non-evaporative and the evaporative spray (Spray A) are calculated. The results indicate that the spray tip penetration is well predicted, although the size of the computational domain must be set equal to that of the experiment.

A fuel design concept for an HCCI engine based on chemical kinetics to optimize the heat release profile and achieve robust ignition was proposed, and applied to the design of the optimal methane-based blend. Ignition process chemistry of each single-component of natural gas, methane, ethane, propane, n-butane and isobutane, was analyzed using detailed chemical kinetic computations. Ethane exhibits low ignitability, close to that of methane, when the initial temperature is below 800 K, but higher ignitability, close to those of propane, n-butane and isobutane, when the initial temperature is above 1100 K. Furthermore, ethane shows a higher heat release rate during the late stage of the ignition process. If the early stage of an ignition process takes place during the compression stroke, this kind of heat release profile is desirable in an HCCI engine to reduce cycle-to-cycle variation during the expansion stroke.

Gasoline includes various kinds of chemical species. Thus, the reaction model of gasoline components that includes the low-temperature oxidation and ignition reaction is necessary to investigate the method to control the combustion process of the gasoline engine. In this study, a gasoline combustion reaction model including n-paraffin, iso-paraffin, olefin, naphthene, alcohol, ether, and aromatic compound was developed. KUCRS (Knowledge-basing Utilities for Complex Reaction Systems) [1] was modified to produce paraffin, olefin, naphthene, alcohol automatically. Also, the toluene reactions of gasoline surrogate model developed by Sakai et al. [2] including toluene, PRF (Primary Reference Fuel), ethanol, and ETBE (Ethyl-tert-butyl-ether) were modified. The universal rule of the reaction mechanisms and rate constants were clarified by using quantum chemical calculation.

Ignition, combustion and emissions characteristics of dual-component fuel spray were examined for ranges of injection timing and intake-air oxygen concentration. Fuels used were binary mixtures of gasoline-like component i-octane (cetane number 12, boiling point 372 K) and diesel fuel-like component n-tridecane (cetane number 88, boiling point 510 K). Mass fraction of i-octane was also changed as the experimental variable. The experimental study was carried out in a single cylinder compression ignition engine equipped with a common-rail injection system and an exhaust gas recirculation system. The results demonstrated that the increase of the i-octane mass fraction with optimizations of injection timing and intake oxygen concentration reduced pressure rise rate and soot and NOx emissions without deterioration of indicated thermal efficiency.

Auto-ignition and combustion processes of dual-component fuel spray were numerically studied. A source code of SUPERTRAPP (developed by NIST), which is capable of predicting thermodynamic and transportation properties of pure fluids and fluid mixtures containing up to 20 components, was incorporated into KIVA3V to provide physical fuel properties and vapor-liquid equilibrium calculations. Low temperature oxidation reaction, which is of importance in ignition process of hydrocarbon fuels, as well as negative temperature coefficient behavior was taken into account using the multistep kinetics ignition prediction based on Shell model, while a global single-step mechanism was employed to account for high temperature oxidation reaction. Computational results with the present multi-component fuel model were validated by comparing with experimental data of spray combustion obtained in a constant volume vessel.

In this study, it is purpose to make clear the effect of cavitation phenomenon on the spray atomization. In this report, the cavitation phenomenon inside the nozzle hole was visualized and the pressure measurements along the wall of the nozzle hole were carried out by use of 25-times enlarged acrylic nozzle. For the representatives of regular gasoline, single and two-component fuels were used as a test fuel. In addition, various cavitating flow patterns same as experimental conditions were simulated by use of Barotropic model incorporated in commercial code of Star-CD scheme, and compared with experimental results.

Methyl butanoate (MB) and methyl decanoate (MD) are surrogates for biodiesel fuels. According to computational results with their detailed reaction mechanisms, MB and MD indicate shorter ignition delays than long alkanes such as n-heptane and n-dodecane do at an initial temperature over 1000 K. The high ignitability of these methyl esters was computationally analyzed by means of contribution matrices proposed by some of the authors. Due to the high acidity of an α-H atom in a carbonyl compound, hydroperoxy radicals are generated out of the equilibrium between forward and backward reactions of O₂ addition to methyl ester radicals by the internal transfer of an α-H atom in the initial stage of an ignition process. Some of the hydroperoxy methyl ester radicals can generate OH to activate initial reactions. MB has an efficient CH₃O formation path via CH₃ generated by the β-scission of an MB radical which has a radical site on the α-C atom to the carbonyl group.

LES of non-evaporative diesel spray have been performed to investigate the effects of breakup models of Modified TAB, WAVE and KHRT model on computational results. KIVALES that is LES version of KIVA code was used for base code. In our KIVALES, CIP scheme was incorporated in order to suppress the numerical diffusion. Results showed that the breakup model is significantly affected on the calculated spray shape, because the droplet diameter determined by breakup models affects on the transmittance of the droplet momentum into the ambient gas, the evolution of the vortex structure in the gas phase and the droplet dispersion by the vortex structure.

Hydrocarbon thermal ignition in internal combustion engines is controlled by the balance of heat release rate by chemical reactions and internal energy formation or removal rate by adiabatic compression or expansion. Heat release rate can be described by a simple “Universal Rule”, that the heat release rate during the thermal ignition preparation period is determined by H2O2 loop composed of four elementary reactions. This rule was validated by sensitivity analysis and response analysis to perturbation of intermediate species concentrations. The rule was applied to clarify several subjects with experimental backgrounds, such as ignition characteristics of higher octane number fuels, an old and well-known knocking model and the influence of H2 addition.

Instantaneous and statistical spray structures of diesel sprays are examined with numerical simulation and experiment. KIVALES, which is LES version of KIVA code, is used as the computational code. Injection velocity profiles measured by momentum method are employed for the initial condition of the calculation. In the experiment, shadowgraph photography is performed to measure macroscopic spray structure. LES approach predicts the instantaneous structure, which are the heterogeneity and intermittency in the periphery of the spray and the cyclic variability of each injection event. Moreover, LES can predict both the instantaneous and statistical spray structures.