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Atmospheric Oxidation Mechanism and Kinetic Studies for OH and NO(3) Radical-Initiated Reaction of Methyl Methacrylate

The mechanism for OH and NO(3) radical-initiated oxidation reactions of methyl methacrylate (MMA) was investigated by using density functional theory (DFT) molecular orbital theory. Geometrical parameters of the reactants, intermediates, transition states, and products were fully optimized at the B3...

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Detalhes bibliográficos
Main Authors: Gao, Rui, Zhu, Ledong, Zhang, Qingzhu, Wang, Wenxing
Formato: Artigo
Idioma:Inglês
Publicado em: Molecular Diversity Preservation International (MDPI) 2014
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3975438/
https://ncbi.nlm.nih.gov/pubmed/24658444
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ijms15035032
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