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arXiv:0903.2341 · Physical Review Letters

Microcanonical Phase Diagrams of Short-Range Ferromagnets

Michael Kästner, Michel Pleimling

Published Jun 19, 2009• 21 citations
arXivHTMLPDF

Abstract

A phase diagram is a graph in parameter space showing the phase boundaries of a many-particle system. Commonly, the control parameters are chosen to be those of the (generalized) canonical ensemble, such as temperature and magnetic field. However, depending on the physical situation of interest, the (generalized) microcanonical ensemble may be more appropriate, with the corresponding control parameters being energy and magnetization. We show that the phase diagram on this parameter space looks remarkably different from the canonical one. The general features of such a microcanonical phase diagram are investigated by studying two models of ferromagnets with short-range interactions. The physical consequences of the findings are discussed, including possible applications to nuclear fragmentation, adatoms on surfaces, and cold atoms in optical lattices.

DOI
10.1103/physrevlett.102.240604

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A phase diagram is a graph in parameter space showing the phase boundaries of a many-particle system. Commonly, the control parameters are chosen to be those of the (generalized) canonical ensemble, such as temperature and magnetic field. However, depending on the physical situation of interest, the (generalized) microcanonical ensemble may be more appropriate, with the corresponding control parameters being energy and magnetization. We show that the phase diagram on this parameter space looks remarkably different from the canonical one. The general features of such a microcanonical phase diagram are investigated by studying two models of ferromagnets with short-range interactions. The physical consequences of the findings are discussed, including possible applications to nuclear fragmentation, adatoms on surfaces, and cold atoms in optical lattices.
Ensemble inequivalence, i.e., the possibility of observing different thermodynamic properties depending on the statistical ensemble which describes the system, is one of the hallmarks of long-range physics, which has been demonstrated in numerous classical systems. Here, an example of ensemble inequivalence of a long-range quantum ferromagnet is presented. While the T=0 microcanonical quantum phase-diagram coincides with that of the canonical ensemble, the phase diagrams of the two ensembles are different at finite temperature. This is in contrast with the common lore of statistical mechanics of systems with short-range interactions where thermodynamic properties are bound to coincide for macroscopic systems described by different ensembles. The consequences of these findings in the context of atomic, molecular, and optical setups are delineated.
Ensemble inequivalence, where a system's thermodynamic properties depend on the statistical ensemble used to describe it, is a well-established phenomenon in classical systems with long-range interactions. Here, we present a detailed analysis of a quantum ferromagnet spin model that exhibits this same behavior. We find that the microcanonical and canonical phase diagrams are identical at zero temperature ( T = 0 ), but differ significantly at finite temperatures. Our results highlight a breakdown of ensemble equivalence in this quantum long-range model, contrasting with what is observed for short range. These findings have important implications for the study and manipulation of long-range interacting quantum platforms, such as those used in atomic, molecular, and optical physics.
Abstract We study the effect of competing interactions on ensemble inequivalence. We consider a one-dimensional Ising model with ferromagnetic mean-field interactions and short-range nearest-neighbor (NN) and next-NN couplings which can be either ferromagnetic or antiferromagnetic. Despite the relative simplicity of the model, our calculations in the microcanonical ensemble reveal a rich phase diagram. The comparison with the corresponding phase diagram in the canonical ensemble shows the presence of phase transition points and lines which are different in the two ensembles. As an example, in a region of the phase diagram where the canonical ensemble shows a critical point and a critical end point, the microcanonical ensemble has an additional critical point and also a triple point. The regions of ensemble inequivalence typically occur at lower temperatures and at larger absolute values of the competing couplings. The presence of two free parameters in the model allows us to obtain a fourth-order critical point, which can be fully characterized by deriving its Landau normal form.
For the spherical model with nearest-neighbour interactions, the microcanonical entropy s (ε, m ) is computed analytically in the thermodynamic limit for all accessible values of the energy ε and the magnetization m per spin. The entropy function is found to be concave (albeit not strictly concave), implying that the microcanonical and the canonical ensembles are equivalent, despite the long-range nature of the spherical constraint that the spins have to obey. Two transition lines are identified in the (ε, m )-plane, separating a paramagnetic phase from a ferromagnetic and an antiferromagnetic one. The resulting microcanonical phase diagram is compared to the more familiar canonical one.
The density of states of long-range Blume—Emery—Griffiths (BEG) and short-range Ising models are obtained by using Wang—Landau sampling with adaptive windows in energy and magnetization space. With accurate density of states, we are able to calculate the microcanonical specific heat of fixed magnetization introduced by Kastner et al. in the regions of positive and negative temperature. The microcanonical phase diagram of the Ising model shows a continuous phase transition at a negative temperature in energy and magnetization plane. However the phase diagram of the long-range model constructed by peaks of the microcanonical specific heat looks obviously different from the Ising chart.
We study the problem of ensemble equivalence in spin systems with short-range interactions under the existence of a first-order phase transition. The spherical model with nonlinear nearest-neighbour interactions is solved exactly for both canonical and microcanonical ensembles. The result reveals apparent ensemble inequivalence at the first-order transition point in the sense that the microcanonical entropy is non-concave as a function of the energy and consequently the specific heat is negative. In order to resolve the paradox, we show that an unconventional saddle point should be chosen in the microcanonical calculation that represents a phase separation. The XY model with nonlinear interactions is also studied by microcanonical Monte Carlo simulations in two dimensions to see how this model behaves in comparison with the spherical model.