Stacking effects in van der Waals heterostructures of blueP and Janus XYO (X = Ti, Zr, Hf: Y = S, Se) monolayers

Using first-principles calculations, the geometry, electronic structure, optical and photocatalytic performance of blueP and XYO (X = Ti, Zr, Hf; Y = S, Se) monolayers and their corresponding van der Waal heterostructures in three possible stacking patterns, are investigated. BlueP and XYO (X = Ti,...

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Detalles Bibliográficos
Autores principales: Alam, Qaisar, Idrees, M., Muhammad, S., Nguyen, Chuong V., Shafiq, M., Saeed, Y., 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/PMC8696924/
https://www.ncbi.nlm.nih.gov/pubmed/35423756
http://dx.doi.org/10.1039/d0ra10827h

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