Time-Dependent Density Functional Theory Study on Electronic Excited-State Hydrogen Bonding of Benzonitrile in Methanol Solution | |
Yang, Dapeng; Qi, Ruiquan | |
刊名 | JOURNAL OF CLUSTER SCIENCE
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2014 | |
卷号 | 25页码:1019-1028 |
关键词 | Hydrogen bond Benzonitrile (PhCN) Time-dependent density functional theory (TDDFT) Excitation energy difference (EED) |
ISSN号 | 1040-7278 |
URL标识 | 查看原文 |
内容类型 | 期刊论文 |
URI标识 | http://www.corc.org.cn/handle/1471x/4427001 |
专题 | 大连理工大学 |
作者单位 | 1.North China Univ Water Resources & Elect Power, Phys Lab, Zhengzhou 450011, Peoples R China. 2.North China Univ Water Resources & Elect Power, Phys Lab, Zhengzhou 450011, Peoples R China. 3.Dalian Univ Technol, Sch Chem Engn, Dalian 116024, Peoples R China. |
推荐引用方式 GB/T 7714 | Yang, Dapeng,Qi, Ruiquan. Time-Dependent Density Functional Theory Study on Electronic Excited-State Hydrogen Bonding of Benzonitrile in Methanol Solution[J]. JOURNAL OF CLUSTER SCIENCE,2014,25:1019-1028. |
APA | Yang, Dapeng,&Qi, Ruiquan.(2014).Time-Dependent Density Functional Theory Study on Electronic Excited-State Hydrogen Bonding of Benzonitrile in Methanol Solution.JOURNAL OF CLUSTER SCIENCE,25,1019-1028. |
MLA | Yang, Dapeng,et al."Time-Dependent Density Functional Theory Study on Electronic Excited-State Hydrogen Bonding of Benzonitrile in Methanol Solution".JOURNAL OF CLUSTER SCIENCE 25(2014):1019-1028. |
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