- 著者
-
三好 明
- 出版者
- 一般社団法人 日本燃焼学会
- 雑誌
- 日本燃焼学会誌 (ISSN:13471864)
- 巻号頁・発行日
- vol.51, no.157, pp.175-181, 2009 (Released:2018-01-26)
- 参考文献数
- 17
Some aspects of the “first-principle” approach to the combustion chemistry, as a tool for understanding the chemical kinetics, are introduced and discussed. The traditional quantum chemical approach based on the multi-layered structure of the combustion science is briefly described. For the future progress of the chemical kinetics of combustion, three indispensable components are discussed; (1) the spread of the quantum chemical methods for the wide-spreading areas of combustion chemistry, including heterogeneous / catalytic combustion, catalyst for exhaust processing, and etc., (2) establishment of empirical approach in combustion chemistry based on the knowledge of the organic chemistry and the refinement by theoretical investigations, and, (3) development of the lumping and reduction methods for huge mechanism of the combustion, which is growing larger and larger, not only for the application with CFD, but also to extract the essentials of the complex mechanisms. Examples of the development of empirical rules are described for several types of reactions which are governing the low-temperature oxidation of hydrocarbons related to the engine-knock problems and the new combustion technologies such as HCCI (homogeneously charge compression ignition).