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Structural Properties of ZnO Nanotubes Under Uniaxial Strain: Molecular Dynamics Simulations
Date
2013-10-01
Author
Kilic, Mehmet Emin
Erkoç, Şakir
Metadata
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This work is licensed under a
Creative Commons Attribution-NonCommercial-NoDerivatives 4.0 International License
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Structural properties of zinc oxide nanotubes with zigzag, armchair and chiral geometries have been investigated by performing classical molecular dynamics simulations. An atomistic potential energy function has been used to represent the interactions among the atoms. Strain has been applied to the generated ZnO nanostructures along their length, which has been realized at two different temperatures, 1 K and 300 K. It has been found that ZnO nanostructures following strain application undergo a structural change depending on temperature, geometry and tube radius.
Subject Keywords
ZnO
,
Zinc oxide nanostructures
,
One dimensional zinc oxide nanostructures
,
Nanotubes
,
Moleculer dynamics simulations
,
Emprical atomistic potentials
URI
https://hdl.handle.net/11511/56611
Journal
JOURNAL OF NANOSCIENCE AND NANOTECHNOLOGY
DOI
https://doi.org/10.1166/jnn.2013.7207
Collections
Department of Physics, Article