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Nuclear quantum effect and H/D isotope effect on Cl· + (H(2)O)(n) → HCl + OH·(H(2)O)(n−1) (n = 1–3) reactions

Cl· + (H(2)O)(n) → HCl + OH·(H(2)O)(n−1) (n = 1–3) reactions are fundamental and important ones in atmospheric chemistry. In this study, we focused on the nuclear quantum effect (NQE) of the hydrogen nucleus on these reactions with the aid of the multicomponent quantum mechanics (MC_QM) method, whic...

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Detalles Bibliográficos
Autores principales:	Sugiura, Keita, Tachikawa, Masanori, Udagawa, Taro
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	The Royal Society of Chemistry 2018
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9080416/ https://www.ncbi.nlm.nih.gov/pubmed/35539263 http://dx.doi.org/10.1039/c8ra02679c

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