A comparison of high-level theoretical methods to predict the heats of formation of azo compounds

Journal of Molecular Structure: THEOCHEM

Volumn 956, Issue 1-3, 2010, Pages 55-60

  Wei, Tao ^a,b   Zhang, Jingjing ^b   Zhu, Weihua ^a   Zhang, Xiaowen ^a   Xiao, Heming ^a  

^a NANJING UNIVERSITY OF SCIENCE AND TECHNOLOGY   (China)

^b WENZHOU MEDICAL UNIVERSITY   (China)

Author keywords

Atomization scheme; Azo compounds; Complete basis set; Gaussian n; Heats of formation

Indexed keywords

EID: 77955657692     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2010.06.027     Document Type: Article

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