C-57 nanotube: electronic, optical, and mechanical properties by DFT calculations

Electronic, optical, and mechanical properties of single-walled C-57 carbon nanotube have been investigated within the framework of density functional theory (DFT). It was found that for the nanotube, there is a direct relationship between its radius and Young’s modulus: larger radius leads to large...

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Bibliografski detalji

Glavni autori:	Mohammad Asadpour, Mahmoud Jafari
Format:	Artigo
Jezik:	Inglês
Izdano:	IOP Publishing 2023-01-01
Serija:	Materials Research Express
Teme:	C-57 carbon nanotube adsorption energy density functional theory (DFT) lithium battery electronic structure
Online pristup:	https://doi.org/10.1088/2053-1591/aced81
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