Simulated structure and thermodynamics of decagonal Al-Co-Cu quasicrystals

Atomic structures of Al-Co-Cu decagonal quasicrystals (dQCs) are investigated using empirical oscillating pair potentials (EOPP) in molecular dynamic (MD) simulations that we enhance by Monte Carlo (MC) swapping of chemical species and replica exchange. Predicted structures exhibit planar decagonal...

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Bibliographic Details
Published in:Physical Review Research
Main Authors: Yang Huang, Michael Widom, M. Mihalkovič
Format: Article
Language:English
Published: American Physical Society 2024-08-01
Online Access:http://doi.org/10.1103/PhysRevResearch.6.033145