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Published in: Journal of Nanoparticle Research 10/2011

01-10-2011 | Research Paper

Molecular dynamics simulation of deposition of nickel nanocluster on copper surface

Authors: Lingqi Yang, Yuwen Zhang, J. K. Chen

Published in: Journal of Nanoparticle Research | Issue 10/2011

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Abstract

The burrowing of nickel nanocluster deposited onto the copper surface is investigated by molecular dynamics (MD) simulation. The simulation is carried out at different temperatures for 40.1 ns with three different lattice orientations Cu(100), Cu(110), and Cu(111) that have 20 × 20 × 15, 14 × 14 × 15, and 12 × 14 × 9 lattice units, respectively. The Ni(100) nanocluster consists of 249 atoms (five lattices diameter) and the initial kinetic energy is assigned to be 0 eV. The results show that the burrowing process goes extremely slow as temperature is at or under 900 K. There is virtually no burrowing observed when the system temperature is below 500 K. The burrowing processes at different temperatures are discussed in terms of kinetic energy of the cluster exerted by the strong capillary force. It is found that the kinetic energy will play a key role in the acceleration of the burrowing process.

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Metadata
Title
Molecular dynamics simulation of deposition of nickel nanocluster on copper surface
Authors
Lingqi Yang
Yuwen Zhang
J. K. Chen
Publication date
01-10-2011
Publisher
Springer Netherlands
Published in
Journal of Nanoparticle Research / Issue 10/2011
Print ISSN: 1388-0764
Electronic ISSN: 1572-896X
DOI
https://doi.org/10.1007/s11051-011-0400-5

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