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cond-mat.mtrl-sci2004
Melting of icosahedral gold nanoclusters from molecular dynamics simulations
Yanting Wang, S. Teitel, Christoph Dellago
Molecular dynamics simulations show that gold clusters with about 600--3000 atoms crystallize into a Mackay icosahedron upon cooling from the liquid. A detailed surface analysis sh…
cond-mat.mtrl-sci2003
Melting and Equilibrium Shape of Icosahedral Gold Nanoparticles
Yanting Wang, S. Teitel, Christoph Dellago
We use molecular dynamics simulations to study the melting of gold icosahedral clusters of a few thousand atoms. We pay particular attention to the behavior of surface atoms, and t…