Atomistic Study of the Bandgap Engineering of Two-Dimensional Silicon Carbide by Hydrogenation

[Image: see text] This work studied hydrogen adsorption by a two-dimensional silicon carbide using a combined molecular dynamics and density functional theory approach. The geometrical properties of partially and fully hydrogenated structures were investigated, considering the effect of zero-point e...

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Detalles Bibliográficos
Autores principales: Thu Tran, Hanh Thi, Nguyen, Phi Minh, Van Nguyen, Hoa, Chong, Tet Vui, Bubanja, Vladimir, Van Vo, Hoang
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10357425/
https://www.ncbi.nlm.nih.gov/pubmed/37483209
http://dx.doi.org/10.1021/acsomega.3c02914

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10357425/
https://www.ncbi.nlm.nih.gov/pubmed/37483209
http://dx.doi.org/10.1021/acsomega.3c02914

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