Journal
JOURNAL OF PHYSICAL CHEMISTRY C
Volume 116, Issue 19, Pages 10814-10818Publisher
AMER CHEMICAL SOC
DOI: 10.1021/jp302260b
Keywords
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Funding
- China Scholarship Council
- Natural Science Foundation of China [11175047]
- Universite Libre de Bruxelles
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The Metropolis Monte Carlo method is used to demonstrate the relationship between the bulk phase diagram of alloys with limited miscibility and the equilibrium configurations of nanoparticles. Using the Au-Pt system as a case study, an embedded atom potential is parametrized so as to match the phase diagram exactly. The smooth temperature dependence of the short-range order parameter is shown correlated with an onion-like configuration intermediate between solid solution and phase separated states.
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