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A First-Principles Study on the Electronic, Thermodynamic and Dielectric Properties of Monolayer Ca(OH)(2) and Mg(OH)(2)

We perform first-principles calculations to explore the electronic, thermodynamic and dielectric properties of two-dimensional (2D) layered, alkaline-earth hydroxides Ca(OH) [Formula: see text] and Mg(OH) [Formula: see text]. We calculate the lattice parameters, exfoliation energies and phonon spect...

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Detalles Bibliográficos
Autores principales:	Rostami Osanloo, Mehrdad, Oyekan, Kolade A., Vandenberghe, William G.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2022
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9147085/ https://www.ncbi.nlm.nih.gov/pubmed/35630994 http://dx.doi.org/10.3390/nano12101774

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