Correlations between the energetics of ZnCd nanoparticles and some of their corresponding bulk properties: molecular-dynamics simulations

Date

2005-02-15

Author

Amirouche, Lynda
Erkoç, Şakir

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The structural stability of Zn-50, Cd-50, Zn25Cd25, Zn12Cd38, and Zn38Cd12 nanoparticles has been investigated by performing molecular-dynamics computer simulations using a recently developed empirical many-body potential energy function. The most stable structures were found to be compact and three dimensional for both elemental and mixed clusters. An interesting structural feature of the mixed clusters is that Zn and Cd atoms do not mix, especially at proportions around the corresponding alloy eutectic composition, they come together almost without mixing. (C) 2004 Elsevier B. V. All rights reserved.

Subject Keywords

Inorganic Chemistry, Materials Chemistry, Condensed Matter Physics

URI

https://hdl.handle.net/11511/57649

Journal

JOURNAL OF CRYSTAL GROWTH

DOI

https://doi.org/10.1016/j.jcrysgro.2004.11.058

Collections

Department of Physics, Article

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Citation Formats

L. Amirouche and Ş. Erkoç, “Correlations between the energetics of ZnCd nanoparticles and some of their corresponding bulk properties: molecular-dynamics simulations,” JOURNAL OF CRYSTAL GROWTH, pp. 0–0, 2005, Accessed: 00, 2020. [Online]. Available: https://hdl.handle.net/11511/57649.