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First-principles study of the adsorption behaviors of Li atoms and LiF on the CF(x) (x = 1.0, 0.9, 0.8, 0.5, ∼0.0) surface

Based on first principles calculation, the adsorption properties of Li atoms and LiF molecules on the fluorographene (CF(x)) surface with different F/C ratios (x = 1.0, 0.9, 0.8, 0.5 and ∼0.0) have been studied in the present work. The calculated binding energy of Li and CF(x) is greater than 2.29 e...

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Detalles Bibliográficos
Autores principales:	Fan, Rujing, Yang, Biao, Li, Zhiwei, Ma, Dandan, Yuan, Wendong, Ma, Jianyi, Ren, Haisheng
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	The Royal Society of Chemistry 2020
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9056575/ https://www.ncbi.nlm.nih.gov/pubmed/35518174 http://dx.doi.org/10.1039/d0ra03635h

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