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Mechanism and kinetics of the atmospheric reaction of 1,3,5-trimethylbenzene bicyclic peroxy radical with OH

The bicyclic peroxy radical (BPR) is the key intermediate during atmospheric oxidation of aromatics. In this paper, the reaction mechanisms and kinetics of the atmospheric reaction of the 1,3,5-trimethylbenzene (1,3,5-TMB) BPR with the OH radical were studied by density functional theory (DFT) and c...

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Detalles Bibliográficos
Autores principales: Lin, Xiaoxiao, Yang, Zhenli, Yu, Hui, Gai, Yanbo, Zhang, Weijun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9073362/
https://www.ncbi.nlm.nih.gov/pubmed/35529717
http://dx.doi.org/10.1039/c9ra06562h