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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.

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.

In this study, a rapid compression and expansion machine(RCEM) with a pancake combustion chamber was designed to investigate fundamentally on the knocking phenomena in spark ignition(S.I) engines. This RCEM is intended to simulate combustion in an actual engine. The homogeneous pre-mixture of n-pentane and air was charged into a quiescent atmosphere of the chamber. Then, the combustion field become simpler in this machine than it in a real S.I. engine. Also, the combustion phenomena, that is a cylinder pressure history, the behavior of flame propagation and so on, with high reproducibility are realized in this machine. The phenomena caught in this experiment were so-called low speed knocking. And, this knocking characteristics such as a knock intensity and a knock mass fraction were revealed by the cylinder pressure analysis varying the charge pressure and the equivalence ratio of the mixture, a compression ratio and an ignition timing.

One of the most effective means of improving the thermal efficiency and the specific fuel consumption in spark ignition engines is the increase of the compression ratio. However, there is a limit to it because of the generation of knocking combustion due to the rise of temperature and pressure in the unburnt mixture. Also in turbo charged spark ignition engines, the ignition timing cannot be advanced until MBT in order to avoid the knocking phenomena. Generally speaking, it is very difficult to investigate the phenomena in an actual engine, because there are many restriction and the phenomena are too complex and too fast. According-ly, it is advantageous to reveal the phenomena fundamentally, including the autoignition process of the end-gas by using simplified model equipment. Therefore, a rapid compression and expansion machine (RCEM) with a pan-cake combustion chamber was designed and developed for the experiments presented here.

Gasoline engines have the trace-knock phenomena induced by the fast combustion which happens a few times during 100 cycles. And that constrains the thermal efficiency improvement due to limiting the ignition timing advance. So the authors have been dedicating a trace-knock simulation so that we could obtain any pieces of information associated with trace-knock characteristics. This simulation consists of a turbulent combustion model, a cycle-by-cycle variation model and a chemical calculation subprogram. In the combustion model, a combustion zone is considered in order to obtain proper turbulent combustion speed through wide range of engine speed. From a cycle-by-cycle variation analysis of an actual gasoline engine, some trace-knock features were detected, and they were involved in the cycle-by-cycle variation model. And a reduced elementary reaction model of gasoline PRF (primary reference fuel) was customized to the knocking prediction, and it was used in the chemical calculation.

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.

Compression ratio of newly developed gasoline engines has been increased in order to improve fuel efficiency. But in-cylinder pressure around top dead center (TDC) before spark ignition timing is higher than expectation, because the low temperature oxidization (LTO) generates some heat. The overview of introduced calculation method taking account of the LTO heat of unburned gas, how in-cylinder pressure is revised and some knowledge of knocking prediction using chemical kinetics are shown in this paper.

In transportation sector, higher engine thermal efficiency is currently required to solve the energy crisis and environmental problems. In spark ignition (SI) engine, lean-burn strategy is the promising approach to improve thermal efficiency and lower emissions. Olefins are the attractive component for gasoline additives, because they are more reactive and have advantage in lean limit extension. However, owing to lower research octane number (RON), it is expected to exhibit the drawback to reducing the anti-knock performance. The experiments were performed using a single-cylinder engine for 6 fuel types including gasoline blends which have difference in RON varying between 90.4 and 100.2. The results showed that adding olefin content to the premium gasoline provided unfavorable effect on auto-ignition as the auto-ignition happened at unburned gas temperature of 808 K which was 52 K lower at excess air of 2.0. Thus, it reduced anti-knock performance.