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Published in 2024 at "Physica Scripta"
DOI: 10.1088/1402-4896/ad607c
Abstract: The optimal chemical ordering configurations of 38-atom trimetallic Pd n Au(32−n)Rh6 nanoalloys with truncated octahedron (TO) geometry were determined through Monte Carlo Basin-Hopping algorithm employing the Gupta potential, followed by local relaxations. Variations in mixing…
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Keywords:
truncated octahedron;
local pressure;
ordering local;
chemical ordering ... See more keywords