Crossover from first- to second-order transition in frustrated Ising antiferromagnetic films

Abstract

In the bulk state, the Ising face-centered-cubic (fcc) antiferromagnet is fully frustrated and is known to have a very strong first-order transition. In this paper, we study the nature of this phase transition in the case of a thin film as a function of the film thickness. Using Monte Carlo simulations, we show that the transition remains first order down to a thickness of four fcc cells (eight atomic layers). It becomes clearly second order at a thickness of two fcc cells, i.e., four atomic layers. It is also interesting to note that the presence of the surface reduces the ground-state degeneracy found in the bulk. For the two-cell thickness, the surface magnetization is larger than the interior one. It undergoes a second-order phase transition at a temperature TC while interior spins become disordered at a lower temperature TD. This loss of order is characterized by a peak of the interior spins susceptibility and a peak of the specific heat which do not depend on the lattice size suggesting that either it is not a real transition or it is a Kosterlitz-Thouless nature. The surface transition, on the other hand, is shown to be of second order with critical exponents deviated from those of pure two-dimensional Ising universality class. We also show results obtained from the Green's function method. A discussion is given.