Study of structural and thermodynamic properties for polychlorinated dibenzothiophenes by density functional theory

Journal of Chemical and Engineering Data

Volumn 52, Issue 4, 2007, Pages 1195-1202

  Chen, Shu D ^a   Liu, Hong X ^b   Wang, Zun Y ^a  

^a JIAXING UNIVERSITY   (China)

^b GUILIN INSTITUTE OF TECHNOLOGY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

AROMATIC COMPOUNDS; CORRELATION METHODS; GAUSSIAN DISTRIBUTION; GIBBS FREE ENERGY; POLYCHLORINATED BIPHENYLS; SPECIFIC HEAT;

ISODESMIC REACTIONS; POLYCHLORINATED DIBENZOTHIOPHENES;

DENSITY FUNCTIONAL THEORY;

EID: 34547684268     PISSN: 00219568     EISSN: None     Source Type: Journal    
DOI: 10.1021/je0604885     Document Type: Article

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