Structural Properties of ZnO Nanotubes Under Uniaxial Strain: Molecular Dynamics Simulations

Date

2013-10-01

Author

Kilic, Mehmet Emin
Erkoç, Şakir

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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

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Citation Formats

M. E. Kilic and Ş. Erkoç, “Structural Properties of ZnO Nanotubes Under Uniaxial Strain: Molecular Dynamics Simulations,” JOURNAL OF NANOSCIENCE AND NANOTECHNOLOGY, pp. 6597–6610, 2013, Accessed: 00, 2020. [Online]. Available: https://hdl.handle.net/11511/56611.