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Evaluation of the effectiveness of AM1 geometry used in calculating O-H bond dissociation enthalpy
Youmin Sun; Dezhan Chen; Chengbu Liu
刊名Journal of Molecular Structure. Theochem: Applications of Theoretical Chemistry to Organic, Inorganic and Biological Problems
2002
卷号618期号:3页码:181-189
关键词O-H bond dissociation enthalpy phenolic compounds AM1 density functional theory
DOI10.1016/S0166-1280(02)00523-7
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/6776286
专题山东大学
作者单位Institute of Theoretical Chemistry, Shandong University, Jinan, Shandong 250100, China, Department of Chemistry, Shandong Teachers' Universit
推荐引用方式
GB/T 7714
Youmin Sun,Dezhan Chen,Chengbu Liu. Evaluation of the effectiveness of AM1 geometry used in calculating O-H bond dissociation enthalpy[J]. Journal of Molecular Structure. Theochem: Applications of Theoretical Chemistry to Organic, Inorganic and Biological Problems,2002,618(3):181-189.
APA Youmin Sun,Dezhan Chen,&Chengbu Liu.(2002).Evaluation of the effectiveness of AM1 geometry used in calculating O-H bond dissociation enthalpy.Journal of Molecular Structure. Theochem: Applications of Theoretical Chemistry to Organic, Inorganic and Biological Problems,618(3),181-189.
MLA Youmin Sun,et al."Evaluation of the effectiveness of AM1 geometry used in calculating O-H bond dissociation enthalpy".Journal of Molecular Structure. Theochem: Applications of Theoretical Chemistry to Organic, Inorganic and Biological Problems 618.3(2002):181-189.
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