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arXiv:cond-mat/0509539 · Physical Review E

Entropic sampling via Wang-Landau random walks in dominant energy subspaces

Anastasios Malakis, S.S. Martinos, Ioannis A. Hadjiagapiou, Nikolaos G. Fytas, P. A. Kalozoumis

Published Dec 22, 2005• 46 citations
arXivHTMLPDF

Abstract

Dominant energy subspaces of statistical systems are defined with the help of restrictive conditions on various characteristics of the energy distribution, such as the probability density and the fourth order Binder's cumulant. Our analysis generalizes the ideas of the critical minimum energy subspace (CRMES) technique, applied previously to study the specific heat's finite-size scaling. Here, we illustrate alternatives that are useful for the analysis of further finite-size anomalies and the behavior of the corresponding dominant subspaces is presented for the two-dimensional (2D) Baxter-Wu and the 2D and 3D Ising models. In order to show that a CRMES technique is adequate for the study of magnetic anomalies, we study and test simple methods which provide the means for an accurate determination of the energy-order-parameter (E,M) histograms via Wang-Landau random walks. The 2D Ising model is used as a test case and it is shown that high-level Wang-Landau sampling schemes yield excellent estimates for all magnetic properties. Our estimates compare very well with those of the traditional Metropolis method. The relevant dominant energy subspaces and dominant magnetization subspaces scale as expected with exponents alpha/nu and gamma/nu, respectively. Using the Metropolis method we examine the time evolution of the corresponding dominant magnetization subspaces and we uncover the reasons behind the inadequacy of the Metropolis method to produce a reliable estimation scheme for the tail regime of the order-parameter distribution.

DOI
10.1103/physreve.72.066120

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Dominant energy subspaces of statistical systems are defined with the help of restrictive conditions on various characteristics of the energy distribution, such as the probability density and the fourth order Binder's cumulant. Our analysis generalizes the ideas of the critical minimum energy subspace (CRMES) technique, applied previously to study the specific heat's finite-size scaling. Here, we illustrate alternatives that are useful for the analysis of further finite-size anomalies and the behavior of the corresponding dominant subspaces is presented for the two-dimensional (2D) Baxter-Wu and the 2D and 3D Ising models. In order to show that a CRMES technique is adequate for the study of magnetic anomalies, we study and test simple methods which provide the means for an accurate determination of the energy-order-parameter (E,M) histograms via Wang-Landau random walks. The 2D Ising model is used as a test case and it is shown that high-level Wang-Landau sampling schemes yield excellent estimates for all magnetic properties. Our estimates compare very well with those of the traditional Metropolis method. The relevant dominant energy subspaces and dominant magnetization subspaces scale as expected with exponents alpha/nu and gamma/nu, respectively. Using the Metropolis method we examine the time evolution of the corresponding dominant magnetization subspaces and we uncover the reasons behind the inadequacy of the Metropolis method to produce a reliable estimation scheme for the tail regime of the order-parameter distribution.
We briefly review some applications of the critical minimum energy-subspace method (CrMES) using the Wang–Landau sampling for the estimation of the density of states (DOS). These applications concern the twoand three-dimensional Ising models and their important conserved order parameter versions (COP), known also as the Ising models with fixed magnetization (IMFM). The recently developed CrMES scheme greatly facilitates methods for sampling the DOS of classical statistical models in large systems. In effect, the CrMES technique enables the estimation of critical behaviour using only a small part of the energy space. Specific heat curves are obtained, their peaks are located and their scaling behaviour is studied and compared with the results known from literature whenever such results exist.
The three-dimensional bimodal random-field Ising model is studied via a new finite temperature numerical approach. The methods of Wang-Landau sampling and broad histogram are implemented in a unified algorithm by using the N-fold version of the Wang-Landau algorithm. The simulations are performed in dominant energy subspaces, determined by the recently developed critical minimum energy subspace technique. The random-fields are obtained from a bimodal distribution, that is we consider the discrete (±Δ) case and the model is studied on cubic lattices with sizes 4≤L ≤20. In order to extract information for the relevant probability distributions of the specific heat and susceptibility peaks, large samples of random-field realizations are generated. The general aspects of the model's scaling behavior are discussed and the process of averaging finite-size anomalies in random systems is re-examined under the prism of the lack of self-averaging of the specific heat and susceptibility of the model.
We present a numerical study of the order-parameter probability density function (PDF) of the square Ising model for lattices with linear sizes L = 80 - 140. A recent efficient entropic sampling scheme, combining the Wang-Landau and broad histogram methods and based on the high levels of the Wang-Landau process in dominant energy subspaces is employed. We find that for large lattices there exists a stable window of the scaled order-parameter in which the full ansatz including the pre-exponential factor for the tail regime of the universal PDF is well obeyed. This window is used to estimate the equation of state exponent and to observe the behavior of the universal constants implicit in the functional form of the universal PDF. The probability densities are used to estimate the universal Privman-Fisher coefficient and to investigate whether one could obtain reliable estimates of the universal constants controlling the asymptotic behavior of the tail regime.
We present a simple and efficient approximation scheme which greatly facilitates the extension of Wang-Landau sampling (or similar techniques) in large systems for the estimation of critical behavior. The method, presented in an algorithmic approach, is based on a very simple idea, familiar in statistical mechanics from the notion of thermodynamic equivalence of ensembles and the central limit theorem. It is illustrated that we can predict with high accuracy the critical part of the energy space and by using this restricted part we can extend our simulations to larger systems and improve the accuracy of critical parameters. It is proposed that the extensions of the finite-size critical part of the energy space, determining the specific heat, satisfy a scaling law involving the thermal critical exponent. The method is applied successfully for the estimation of the scaling behavior of specific heat of both square and simple cubic Ising lattices. The proposed scaling law is verified by estimating the thermal critical exponent from the finite-size behavior of the critical part of the energy space. The density of states of the zero-field Ising model on these lattices is obtained via a multirange Wang-Landau sampling.
Abstract. The critical properties of the randomly site-diluted two-dimensional Ising model were studied using the Wang-Landau algorithm. The concentration of nonmagnetic sites was q = 0.1; the remaining sites were occupied by magnetic particles. The study was carried out in the appro-priate restricted but dominant energy subspaces. The main effort was focused on the specific heat and magnetic susceptibility by using the density of states for the model for lattices with linear size L = 20-120. The finite size scaling behavior of the specific heat and susceptibility was studied. The ratio of the critical exponents (α/ν) is negative (consistent with the Harris criterion), while the ratio (γ/ν) appears to assume its pure Ising model value (weak universality). 1.
We apply the recently developed critical minimum-energy subspace scheme for the investigation of the random-field Ising model. We point out that this method is well suited for the study of this model. The density of states is obtained via the Wang-Landau and broad histogram methods in a unified implementation by employing the N-fold version of the Wang-Landau scheme. The random fields are obtained from a bimodal distribution (hi = +/-2), and the scaling of the specific heat maxima is studied on cubic lattices with sizes ranging from L=4 to L=32. Observing the finite-size scaling behavior of the maxima of the specific heats we examine the question of saturation of the specific heat. The lack of self-averaging of this quantity is fully illustrated, and it is shown that this property may be related to the question mentioned above.