标题:Mechanism and kinetic properties of NO_3-initiated atmospheric degradation of DDT
作者:Cai Liu;Shanqing Li;Rui Gao;Juan Dang;Wenxing Wang;Qingzhu Zhang;
作者机构:[Cai Liu;Shanqing Li;Rui Gao;Juan Dang;Wenxing Wang;Qingzhu Zhang]Environment Research Institute, Shandong University
通讯作者:Zhang, Q.(zqz@sdu.edu.cn)
通讯作者地址:[Zhang, QZ]Shandong Univ, Environm Res Inst, Jinan 250100, Peoples R China.
来源:Journal of Environmental Sciences
出版年:2014
卷:26
期:3
页码:601-607
DOI:10.1016/S1001-0742(13)60388-5
关键词:DDT NO3 radicals atmospheric oxidation reaction mechanism rate constants
摘要:In this article, the NO3 radical-initiated atmospheric oxidation degradation of DDT was theoretically investigated using molecular orbital theory calculations. All the calculations of intermediates, transition states and products were performed at the MPWB1K/6-311+G(3df,2p)//MPWB1K/6-31+G(d,p) level...
收录类别:EI;CSCD;SCOPUS;SCIE
WOS核心被引频次:1
Scopus被引频次:3
资源类型:期刊论文
原文链接:http://kns.cnki.net/kns/detail/detail.aspx?FileName=HJKB201403014&DbName=CJFQ2014
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