Molecular Dynamics Simulations of ZnO Nanostructures Under Strain: II-Nanorods

Date

2013-01-01

Author

Kilic, Mehmet Emin
Erkoç, Şakir

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Structural properties of zinc oxide nanorods have been investigated by performing classical molecular dynamics simulations. 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 and geometry.

Subject Keywords

Electrical and Electronic Engineering, General Materials Science, General Chemistry, Condensed Matter Physics, Computational Mathematics

URI

https://hdl.handle.net/11511/51935

Journal

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE

DOI

https://doi.org/10.1166/jctn.2013.2665

Collections

Department of Physics, Article

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Citation Formats

M. E. Kilic and Ş. Erkoç, “Molecular Dynamics Simulations of ZnO Nanostructures Under Strain: II-Nanorods,” JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE, pp. 112–118, 2013, Accessed: 00, 2020. [Online]. Available: https://hdl.handle.net/11511/51935.