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Atomic structure of Pd n (4 ≤ n ≤ 15) nanoclusters

Authors :
E. A. Mikhaĭlov
A. T. Kosilov
Source :
Physics of the Solid State. 52:426-430
Publication Year :
2010
Publisher :
Pleiades Publishing Ltd, 2010.

Abstract

The results of molecular dynamics simulation of the process of atom-by-atom growth of palladium nanoparticles are presented. The structures obtained for the Pdn clusters agree well with the results of the first-principles calculations. The low-symmetry atomic configurations for the structure of the Pd4 and Pd13 clusters have been obtained using the semiempirical potentials of the interatomic interaction for the first time.

Details

ISSN :
10906460 and 10637834
Volume :
52
Database :
OpenAIRE
Journal :
Physics of the Solid State
Accession number :
edsair.doi...........2327d500ccdf886e2ba3a6664e7314d3
Full Text :
https://doi.org/10.1134/s1063783410020332