| Theoretical study on the reaction mechanism of (CH_3)_3CO~· radical with NO |
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| 作者姓名： | ZHAO Hongmei LIU Kun SUN Chengke & LI Zonghe . |
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| 作者单位： | ZHAO Hongmei1，2，LIU Kun1，SUN Chengke1 & LI Zonghe1 1. Department of Chemistry，Beijing Normal University，Beijing 100875，China; 2. Department of Chemistry，Beihua University，Jilin 132013，China |
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| 摘 要： | Alkoxy radicals RO? form an important class of hydrocarbon oxidation intermediates in combustion processes, interstellar and atmospheric chemistry1—8]. The number of NO to NO2 conversions can take place during the oxidation of the parent hydrocarbon in the atmosphere and hence affecting tropospheric ozone production. The experimental and theoretical investi-gations of the reactions of alkoxy radicals will be ad-vantageous for safeguarding the environment. Despite the importance of alkoxy r…
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| 关 键 词： | CH3)3CO~· radical DFT reaction mechanism NO. |
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