Experimental and Computational Studies of the Kinetics of Alkoxy Radicals

烷氧基自由基动力学的实验和计算研究

• 批准号: 0087057
• 负责人: Theodore Dibble
• 金额: $ 30万
• 依托单位: SUNY College of Environmental Science and Forestry
• 依托单位国家: 美国
• 项目类别: Continuing Grant
• 财政年份: 2001
• 资助国家: 美国
• 起止时间: 2001-03-01 至 2005-02-28
• 项目状态: 已结题
• 来源: https://www.nsf.gov/awardsearch/showAward?AWD_ID=0087057&HistoricalAwards=false
• 关键词: Experimental; Computational; Studies; Kinetics; Alkoxy

This project involves laboratory studies and supporting computational research to obtain rate constants for reactions of selected alkoxy radicals of importance in atmospheric chemistry. The long-term goal for the research is to build a database for use in determining the atmospheric fate of alkoxy radicals and the degradation pathways of volatile organic compounds (VOC) in the atmospheric. This research will make an important contribution to our mechanistic understanding of tropospheric ozone production and enable better modeling of ozone formation in smog episodes.

该项目包括实验室研究和辅助计算研究，以获得在大气化学中具有重要意义的选定烷氧基的反应速率常数。这项研究的长期目标是建立一个数据库，用于确定烷氧基在大气中的去向和大气中挥发性有机化合物(VOC)的降解途径。这项研究将对我们从机制上理解对流层臭氧产生做出重要贡献，并使我们能够更好地模拟雾霾事件中臭氧的形成。