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Engineering the band gap and optical properties of a two-dimensional molybdenum carbon fluoride MXene

Using first-principles density functional theory, we investigated the electronic and optical properties of monolayer and multilayer nanosheets of molybdenum carbon fluoride (Mo(2)CF(2)), a two-dimensional (2D) transition-metal carbide MXene. The indirect band gap of the Mo(2)CF(2) semiconductor can...

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Detalles Bibliográficos
Autores principales:	Anh, Doan Thi Kieu, Mui, Luong Viet, Minh, Pham Hong, Binh, Nguyen Thanh, Cadatal-Raduban, Marilou
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	International Union of Crystallography 2022
Materias:	Research Papers
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9533315/ http://dx.doi.org/10.1107/S2052520622007387

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