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Computational Approach To Reveal the Structural Stability and Electronic Properties of Lithiated M/CNT (M = Si, Ge) Nanocomposites as Anodes for Lithium-Ion Batteries

[Image: see text] This work is motivated to explore the structural stability and electronic and electrochemical properties of nanocomposites of M(4)Li(n) (M = Si and Ge)–carbon nanotube (CNT) by employing first-principles density functional theory calculations. By analyzing the structural stability...

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Detalles Bibliográficos
Autores principales: Bijoy, T. K., J, Karthikeyan, Murugan, P.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2019
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6648306/
https://www.ncbi.nlm.nih.gov/pubmed/31459624
http://dx.doi.org/10.1021/acsomega.8b03433