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Proceedings Paper

Geometrical structure of small Co nanoparticles
Author(s): Jelena Tamulienė; Rimas Vaišnoras; Mindaugas-Leonas Balevičius; Loreta Rastinienė
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Paper Abstract

Electronic and geometrical structures of Con (n=4, 6, 8) particles have been studied using both the density functional theory and the Hartree-Fock calculations. Structural differences to the corresponding clusters are presented. Four-fold coordination of the Co atoms was found to be a particularly preferable coordination environment in small Con species. The key element of the Co particle is suggested.

Paper Details

Date Published: 25 January 2007
PDF: 5 pages
Proc. SPIE 6596, Advanced Optical Materials, Technologies, and Devices, 65961G (25 January 2007); doi: 10.1117/12.726518
Show Author Affiliations
Jelena Tamulienė, Institute of Theoretical Physics and Astronomy (Lithuania)
Vilnius Pedagogical Univ. (Lithuania)
Rimas Vaišnoras, Vilnius Pedagogical Univ. (Lithuania)
Mindaugas-Leonas Balevičius, Vilnius Univ. (Lithuania)
Loreta Rastinienė, Vilnius Pedagogical Univ. (Lithuania)

Published in SPIE Proceedings Vol. 6596:
Advanced Optical Materials, Technologies, and Devices
Steponas Ašmontas; Jonas Gradauskas, Editor(s)

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