Intriguing electronic, optical and photocatalytic performance of BSe, M(2)CO(2) monolayers and BSe–M(2)CO(2) (M = Ti, Zr, Hf) van der Waals heterostructures

Using density functional (DFT) theory calculations, we have investigated the electronic band structure, optical and photocatalytic response of BSe, M(2)CO(2) (M = Ti, Zr, Hf) monolayers and their corresponding BSe–M(2)CO(2) (M = Ti, Zr, Hf) van der Waals (vdW) heterostructures. Optimized lattice con...

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Detalles Bibliográficos
Autores principales: Munawar, M., Idrees, M., Ahmad, Iftikhar, Din, H. U., Amin, B.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2021
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8978625/
https://www.ncbi.nlm.nih.gov/pubmed/35424496
http://dx.doi.org/10.1039/d1ra07569a

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