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Theoretical investigation on the adsorption configuration and (•)OH-initiated photocatalytic degradation mechanism of typical atmospheric VOCs styrene onto (TiO(2))(n) clusters

In this study, the adsorption mechanism and hydroxyl radical ((•)OH)-initiated photocatalytic degradation mechanism of styrene onto different (TiO(2))(n) clusters were investigated using density functional theory. Styrene, a typical model atmospheric volatile organic compound (VOC), was found to be...

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Detalles Bibliográficos
Autores principales: Wang, Honghong, Ji, Yuemeng, Chen, Jiangyao, Li, Guiying, An, Taicheng
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4601031/
https://www.ncbi.nlm.nih.gov/pubmed/26455501
http://dx.doi.org/10.1038/srep15059