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The High-Effective Catalytic Degradation of Benzo[a]pyrene by Mn-Corrolazine Regulated by Oriented External Electric Field: Insight From DFT Study

The degradation of BaP into hydroxybenzo[a]pyrene by Mn-corrolazine and its regulation by an oriented external electronic field (OEEF) were systematically studied using first-principle calculations. Extensive density function calculations showed that the degradation of BaP into hydroxybenzo[a]pyrene...

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Detalles Bibliográficos
Autores principales:	Long, Tairen, Wan, Haiyan, Zhang, Jianqiang, Wu, Jie, Liang, Jin-Xia, Zhu, Chun
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Frontiers Media S.A. 2022
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9201028/ https://www.ncbi.nlm.nih.gov/pubmed/35720998 http://dx.doi.org/10.3389/fchem.2022.884105

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