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Superdegenerate point in FCC phase diagram: CVM and Monte Carlo investigations
Authors:R. Tétot  A. Finel  F. Ducastelle
Affiliation:(1) ONERA, BP 72, 92322 Chatillon Cedex, France;(2) Present address: Laboratoire des Composés Non Stoechiométriques, Université Paris Sud, Centre d'Orsay, 91405 Orsay Cedex, France
Abstract:
We investigate the topology of the phase diagram of binary alloys on the fee lattice with first-neighbor antiferromagnetic interactions around the superdegenerate point, where the L10 and L12 phases meet. We treat the system as a ldquohard-constraint lattice gas,rdquo following a procedure previously described by Lebowitzet al. We perform cluster variation method calculations in theTrarr0 limit and Monte Carlo simulations directly atT=0 K on the ground states of the superdegenerate point. We find that: (i) there is no disordered phase in the neighborhood of this point; (ii) a phase Lprime for which two of the four cubic sublattices have the same average occupancy and each of the two others are different appears between L10 and L12; (iii) the transition Lprime/L12 is of first order.
Keywords:Ising model  superdegenerate ground states  cluster variation method  Monte Carlo simulations  constrained lattice gas
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