Mechanisms of reactive oxygen species photogeneration by benzo[a]pyrene: A DFT study

Journal of Molecular Structure: THEOCHEM

Volumn 893, Issue 1-3, 2009, Pages 6-8

  Ji, Hong Fang ^a   Shen, Liang ^a  

^a SHANDONG UNIVERSITY OF TECHNOLOGY   (China)

Author keywords

Benzo a pyrene; Density functional theory; Reactive oxygen species; Triplet excited state

Indexed keywords

EID: 84962433313     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2008.09.009     Document Type: Article

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