Effect of Pt Decoration on the Optical Properties of Pristine and Defective MoS(2): An Ab-Initio Study

Using structural relaxation calculations and first-principles molecular dynamics (FPMD), we performed numerical simulations to explore the interaction of a 2D MoS(2) surface and a platinum atom, calculating the optical properties of the resulting material. We explored three initial positions for the...

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Detalles Bibliográficos
Autores principales: Ramírez-de-Arellano, Juan Manuel, Jiménez-González, Ali Fransuani, Canales, Mónica, Magaña, Luis Fernando
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2022
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9569481/
https://www.ncbi.nlm.nih.gov/pubmed/36232499
http://dx.doi.org/10.3390/ijms231911199

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9569481/
https://www.ncbi.nlm.nih.gov/pubmed/36232499
http://dx.doi.org/10.3390/ijms231911199

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