Multiatom interactions in the fcc Ising binary alloy: Low-temperature behavior and Monte Carlo simulations

Daniel F. Styer, Mohan K. Phani, Joel Lebowitz

Research output: Contribution to journalArticle

53 Scopus citations

Abstract

We investigate an Ising model of an ordering binary alloy on the face-centered-cubic lattice, such as Cu-Au. This model contains multiatom interactions on the triangles and tetrahedra of the lattice as well as the usual repulsions on the nearest-neighbor bonds. We examine the models ground states and its low-temperature equilibrium states: There are an infinite number of the former but only a few of the latter. We also study its phase diagram using Monte Carlo simulations, which confirm the broad conclusions of previous cluster-variation-method calculations, particularly near stoichiometry. Even small triangular interactions can introduce dramatic asymmetry into the phase diagram, making it similar to those observed in real alloys.

Original languageEnglish (US)
Pages (from-to)3361-3370
Number of pages10
JournalPhysical Review B
Volume34
Issue number5
DOIs
StatePublished - Jan 1 1986

All Science Journal Classification (ASJC) codes

  • Condensed Matter Physics

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