Structure and electronic properties of MoS2 nanotubes

Gotthard Seifert; Humberto Terrones; Mauricio Terrones; Gerd Jungnickel; Thomas Frauenheim

doi:10.1103/PhysRevLett.85.146

Structure and electronic properties of MoS₂ nanotubes

Gotthard Seifert
, Humberto Terrones
, Mauricio Terrones
, Gerd Jungnickel
, Thomas Frauenheim

Research output: Contribution to journal › Article › peer-review

533 Scopus citations

Abstract

The problem of the stability and electronic properties of zigzag and armchair MoS₂ nanotubes was addressed using the density-functional-based tight-binding (DFT) method. It was found that the strain energy of all the nanotubes behaves similarly to carbon nanotubes. The structure of the MoS nanotube tips and the closure of polyhedral particles were explained based on topological defects.

Original language	English (US)
Pages (from-to)	146-149
Number of pages	4
Journal	Physical review letters
Volume	85
Issue number	1
DOIs	https://doi.org/10.1103/PhysRevLett.85.146
State	Published - Jul 3 2000

All Science Journal Classification (ASJC) codes

General Physics and Astronomy

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10.1103/PhysRevLett.85.146

Cite this

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abstract = "The problem of the stability and electronic properties of zigzag and armchair MoS2 nanotubes was addressed using the density-functional-based tight-binding (DFT) method. It was found that the strain energy of all the nanotubes behaves similarly to carbon nanotubes. The structure of the MoS nanotube tips and the closure of polyhedral particles were explained based on topological defects.",

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AU - Terrones, Mauricio

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AU - Frauenheim, Thomas

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Structure and electronic properties of MoS₂ nanotubes

Abstract

All Science Journal Classification (ASJC) codes

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