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In this study, reaction path analysis and modeling of NOx reduction phenomena by fast SCR reaction on a Cu-chabazite catalyst were conducted, considering the formation and decomposition of ammonium nitrate (NH4NO3). White crystals of NH4NO3 decompose at temperatures < 200 °C. Thus, the reaction behavior changes at 200 °C under fast SCR reaction conditions. NH4NO3 formation can occur on both Cu sites and Brønsted acid sites, which are active sites for NOx reduction in the Cu-chabazite catalyst, but it is unclear where NH4NO3 accumulates on the catalyst. Analyses using catalyst test pieces with different active sites were performed to estimate this accumulation. The results suggested that NH4NO3 accumulation does not depend on the presence of either Cu sites or Brønsted acid sites. Therefore, it is assumed that NH4NO3 can be accumulated everywhere on the catalyst, including on the zeolite framework. This phenomenon was included in the model as formation/accumulation sites S'.

The purpose of this paper is to find a universal law to predict a turbulent burning velocity under various operating conditions and engine specifications. This paper presents the relationship between turbulent burning velocity and Karlovitz number. The turbulent burning velocity was measured using a single-cylinder gasoline engine, which has an external Exhaust Gas Recirculation (EGR) system. In the experiment, various engine operating parameters, e.g. engine speed and EGR rates, and various engine specifications, i.e. different types of intake ports were tested. Karlovitz number was calculated with Three Dimensional Computational Fluid Dynamics (3D-CFD) and detailed chemical reaction calculation, which condition was based on the experiment. The experimental and calculation results show that turbulent burning velocity is predicted by using Karlovitz number in the engine conditions, which varies depending on engine speed, EGR rates and the designs of intake ports.

Natural gas has been used in spark-ignition (SI) engines of natural gas vehicles (NGVs) due to its resource availability and stable price compared to gasoline. It has the potential to reduce carbon monoxide emissions from the SI engines due to its high hydrogen-to-carbon ratio. However, short running distance is an issue of the NGVs. In this work, methodologies to improve the fuel economy of a heavy-duty commercial truck under the Japanese Heavy-Duty Driving Cycle (JE05) is proposed by numerical 1D-CFD modeling. The main objective is a comparative analysis to find an optimal fuel economy under three variable mechanisms, variable valve timing (VVT), variable valve actuation (VVA), and variable compression ratio (VCR). Experimental data are taken from a six-cylinder turbocharged SI engine fueled by city gas 13A. The 9.83 L production engine is a CR11 type with a multi-point injection system operated under a stoichiometric mixture.

Heavy soot deposition in wall-flow type diesel particulate filters reduces engine output and fuel efficiency. This necessitates forced regeneration to oxidize soot via exothermic reactions in a diesel oxidation catalyst upstream of the Diesel Particulate Filter (DPF). Soot loading in the wall of the DPF during forced regeneration causes much greater pressure drops than cake deposition, which is undesirable because high pressure drops reduce engine performance. We show that the description of soot deposition using a DPF model is improved by using a shrinking sphere soot oxidation sub-model. We then use this revised model to analyze cake deposition during forced regeneration, and to study the effects of varying the forced regeneration temperature and duration on the local soot reaction rate and soot mass distribution in the radial and longitudinal directions of the DPF channels during forced regeneration.

The purpose of this paper is to build up a model for predicting turbulent burning velocity which can be used for One-Dimensional (1D) engine simulation. This paper presents the relationship between turbulent burning velocity, the Karlovitz number, and the Markstein number for building up the prediction model. The turbulent burning velocity was measured using a single-cylinder gasoline engine, which has an external Exhaust Gas Recirculation (EGR) system. In the experiment, various engine operating parameters, e.g. engine loads and EGR rates, and various engine specifications, i.e. different types of intake ports were tested. The Karlovitz number was calculated using Three-Dimensional Computational Fluid Dynamics (3D-CFD) and detailed chemical kinetics simulation with a premixed laminar flame model. The Markstein number was also calculated using detailed chemical kinetics simulation with the Extinction of Opposed-flow Flame model.

The purpose of the present study is to find a way to extend a combustion stability limit for diluted combustion in a spark-ignition (SI) gasoline engine which has a high compression ratio. This paper focuses on partial oxidation in an unburned mixture which is observed in the high compression engine and clarifies the effect of partial oxidation in an unburned mixture on the behavior of a flame stretch and the extinction limit. The behavior of the flame stretch was simulated using the detailed chemical kinetics simulation with the opposed-flow flame reactor model. In the simulation, the reactants which have various reaction progress variables were examined to simulate the flame stretch and extinction under the partial oxidation conditions. The mixtures were also diluted by complete combustion products which represent exhaust gas recirculation (EGR).

Soot mass production was investigated in high-boosted diesel engine tests by changing various operating parameters. A mixed timescale subgrid model of large eddy simulation (LES) was applied to simulate the detailed mixture formation, combustion and soot formation influenced by turbulence in diesel engine combustion. The combustion model used a direct integration approach with an explicit ordinary differential equation (ODE) solver and additional parallelization by OpenMP. Soot mass production within a computation cell was determined from a phenomenological soot formation model developed by WASEDA University. The model was combined with the LES code and included the following important steps: particle inception, in which naphthalene was assumed to grow irreversibly to form soot; surface growth with the addition of C2H2; surface oxidation due to OH radicals and O2 attack; particle coagulation; and particle agglomeration.

The objective of this article is to clarify the effect of thermal and equivalence ratio stratification on Homogeneous Charge Compression Ignition (HCCI) combustion under several conditions with three-dimensional computational fluid dynamics (3D CFD). Reynolds Averaged Navier-Stokes (RANS) simulation was used to calculate in-cylinder fluid dynamics. The 3D CFD simulation is also coupled with detailed chemical reaction to calculate HCCI combustion. First, the study with a simple engine model reveals that thermal stratification is more effective for prolonged combustion duration, which is a key factor for a high load limit of HCCI combustion, than equivalence ratio stratification. Thermal stratification has two-stage combustion: the combustion propagates from hot region slowly at first and then ignites in the entire in-cylinder region. Owing to this phenomenon, thermal stratification is more effective to mitigate HCCI combustion.

A mixed time-scale subgrid large eddy simulation was used to simulate mixture formation, combustion and soot formation under the influence of turbulence during diesel engine combustion. To account for the effects of engine wall heat transfer on combustion, the KIVA code's standard wall model was replaced to accommodate more realistic boundary conditions. This were carried out by implementing the non-isothermal wall model of Angelberger et al. with modifications and incorporating the log law from Pope's method to account for the wall surface roughness. Soot and NOx emissions predicted with the new model are compared to experimental data acquired under various EGR conditions.

This paper describes the development of an integrated simulation model for evaluating the effects of electrically heating the three-way catalyst (TWC) in a series hybrid electric vehicle (s-HEV) on fuel economy and exhaust gas purification performance. Engine and TWC models were developed in GT-Power to predict exhaust emissions during transient operation. These models were validated against data from vehicle tests using a chassis dynamometer and integrated into an s-HEV model built in MATLAB/Simulink. The s-HEV model accurately reproduced the performance characteristics of the vehicle’s engine, motor, generator, and battery during WLTC mode operation. It can thus be used to predict the fuel consumption, emissions, and performance of individual powertrain components. The engine combustion characteristics were reproduced with reasonable accuracy for the first 50 combustion cycles, representing the cold-start condition of the driving mode.

The objective of the present research is to analyze the effects of using oxygenated fuels (FAMEs) on diesel engine combustion and emission (NOx and soot). We studied methyl oleate (MO), which is an oxygenated fuel representative of major constituents of many types of biodiesels. Engine tests and numerical simulations were performed for 100% MO (MO100), 40% MO blended with JIS#2 diesel (MO40) and JIS#2 diesel (D100). The effects of MO on diesel combustion and emission characteristics were studied under engine operating conditions typically encountered in passenger car diesel engines, focusing on important parameters such as pilot injection, injection pressure and exhaust gas recirculation (EGR) rate. We used a diesel engine complying with the EURO4 emissions regulation, having a displacement of 2.2 L for passenger car applications. In engine tests comparing MO with diesel fuel, no effect on engine combustion pressure was observed for all conditions tested.

Compared with petroleum fuel, liquefied petroleum gas (LPG) demonstrates advantages in low CO₂ emission. This is because of propane (C₃H₈), n-butane (n-C₄H₁₀) and i-butane (i-C₄H₁₀), which are the main components of LPG, making H/C ratio higher. In addition, LPG is suitable for high efficient operation of a spark ignition (SI) engine due to its higher research octane number (RON). Because of these advantages, that is, diversity of energy source and reduction of CO₂, in the past several years, LPG vehicles have widely been used as the alternate gasoline vehicles all over the world. Consequently, it is absolutely essential for the performance increase in LPG vehicles to comprehend combustion characteristics of LPG. In this study, the differences of laminar burning velocity between C₃H₈, n-C4H10, i-C₄H₁₀ and regular gasoline were evaluated experimentally with the use of a constant volume combustion chamber (CVCC).

In this study, we selected four unregulated emissions species, formaldehyde, benzene, 1,3-butadiene and benzo[a]pyrene to research the emission characteristics of these unregulated components experimentally. The engine used was a water-cooled, 8-liter, 6-cylinder, 4-stroke-cycle, turbocharged DI diesel engine with a common rail fuel injection system manufactured for the use of medium-duty trucks, and the fuel used was JIS second-class light gas oil, which is commercially available as diesel fuel. The results of experiments indicate as follows: formaldehyde tends to be emitted under the low load condition, while 1,3-butadiene is emitted at the low engine speed. This is believed to be because 1,3-butadiene decomposes in a short time, and the exhaust gas stays much longer in a cylinder under the low speed condition than under the high engine speed one. Benzene is emitted under the low load condition, as it is easily oxidized in high temperature.

Swirl injector spray at high fuel temperatures has unique characteristics [1][2][3][4] compared to normal fuel temperature spray such as strong penetration and narrow spray width. These characteristics have a possibility for improving fuel consumption and exhaust emission at the cold start condition. Thus, Swirl injector spray at high fuel temperature conditions was modeled in a CFD(Computational Fluid Dynamics) code by using a multi components fuel evaporation model and other spray sub-models to predict the mixture formation process at the cold start condition. Results show that, high temperature fuel decreases wall film amount and increases vapor amount. It can be concluded that high temperature fuel has the possibility for improving fuel consumption and exhaust emission at the cold start condtion.

A numerical study was carried out to investigate combustion characteristics of a dual-fuel gas diesel engine, using a multi-dimensional model combined with detailed chemical kinetics, including 43 chemical species and 173 elementary reactions. In calculations, the effects of initial temperature, EGR ratios on ignition, and combustion were examined. The results indicated EGR combined with intake preheating can favorably reduced NOx and THC emissions simultaneously. This can be explained by the fact that combustion mechanism is changed from flame propagation to HCCl like combustion.

A dual fuel natural gas diesel engine suffers from remarkably lower thermal efficiency and higher THC, CO emissions at lower load because of its lower burned mass fraction caused by the lean pre-mixture. To overcome this inevitable disadvantage at lower load, two methods of reducing the number of operating cylinders were examined. One method was to use the two cylinders operation while the second one was to use the quasi-two cylinders operation. As a result, it was found that the unburned hydrocarbons and CO emissions could be favorably reduced with the improvement of thermal efficiency by reducing the number of cylinders to half for a dual fuel natural gas diesel engine. Moreover, it was also found that the quasi-two cylinders operation could improve the torque fluctuation more compared to the two cylinders operation.

A numerical study was carried out to investigate auto-ignition characteristics during HCCI predicted by using zero and multi-dimensional models combined with detailed kinetics including 116 chemical species and 689 elementary reactions involving iso-octane. In the simulation, homogeneous charge compression ignition of the fuel was analyzed under the same conditions as encountered in internal combustion engines. The results elucidated the combustible region and oxidation process of iso-octane with the formation and destruction of various chemical species in the cylinder.

A CFD code combined with detailed chemical kinetics has been developed, linking with KIVA-3 and subroutines in CHEMKIN-II directly with some modifications. By using this CFD code, formation processes of combustion and exhaust gas emission for a turbo-charged DI diesel engine with common rail fuel injection system were simulated. As a result, formation processes of pollutant including NOx and soot were also considered according to the calculation results. The results show that NO caused by the extended Zeldvich mechanism accounted for about 88% of all NO, and it was found that there is a possibility to predict where and when soot will be formed by considering a simplified soot formation model.

Fuel temperature in the injector of small direct injection gasoline engine is high. On some conditions it is higher than saturated temperature. Over saturated temperature spray characteristics greatly change. In order to predict in-cylinder phenomena accurately, it is important to understand spray behavior and mixture process above saturated temperature. Therefore spray shape, mixture formation process and Sauter mean radius were (SMR) measured in a constant volume chamber. And based on the measurement result initial spray boundary conditions were arranged so that spray characteristics over saturated temperature could be represented by using CFD code KIVA-3[1]. Moreover KIVA-3 code was combined with detailed chemical kinetics code Chemkin II to predict combustion products. [2] Calculated combustion process was validated with visualization of chemiluminescence. As a result, spray shape and penetration length have good agreement with measured ones for each fuel temperature.

Natural gas pre-mixture is ignited by a small amount of pilot fuel in the dual fuel engine. In this paper, numerical studies were carried out to investigate the combustion and exhaust gas emissions formation process of this engine type by using a multi dimensional model combined with the detailed chemical kinetics including 57 chemical species and 290 elementary reactions. In calculation, the effect of the pre-mixture concentration on combustion was examined. The result indicated that the increased concentration of natural gas could improve the burning fraction and THC, CO emissions due to the increased pre-mixture consumption rate and the cylinders gas temperature.