Bandgap atomistic calculations on hydrogen-passivated GeSi nanocrystals

We present a detailed study regarding the bandgap dependence on diameter and composition of spherical Ge-rich Ge(x)Si(1−x) nanocrystals (NCs). For this, we conducted a series of atomistic density functional theory (DFT) calculations on H-passivated NCs of Ge-rich GeSi random alloys, with Ge atomic c...

Descripción completa

Detalles Bibliográficos
Autores principales: Cojocaru, Ovidiu, Lepadatu, Ana-Maria, Nemnes, George Alexandru, Stoica, Toma, Ciurea, Magdalena Lidia
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2021
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8245600/
https://www.ncbi.nlm.nih.gov/pubmed/34193909
http://dx.doi.org/10.1038/s41598-021-92936-z

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8245600/
https://www.ncbi.nlm.nih.gov/pubmed/34193909
http://dx.doi.org/10.1038/s41598-021-92936-z

Ejemplares similares