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Physical Review Letters

Exact Distribution of Energies in the Two-Dimensional Ising Model

Paul D. Beale

Published Jan 1, 1996• 191 citations
Publisher

Abstract

The low-temperature series expansion for the partition function of the two-dimensional Ising model on a square lattice can be determined exactly for finite lattices using Kaufman's generalization of Onsager's solution. The exact distribution function for the energy can then be determined from the coefficients of the partition function. This provides an exact solution with which one can compare energy histograms determined in Monte Carlo simulations. This solution should prove useful for detailed studies of statistical and systematic errors in histogram reweighting.

DOI
10.1103/physrevlett.76.78

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The low-temperature series expansion for the partition function of the two-dimensional Ising model on a square lattice can be determined exactly for finite lattices using Kaufman's generalization of Onsager's solution. The exact distribution function for the energy can then be determined from the coefficients of the partition function. This provides an exact solution with which one can compare energy histograms determined in Monte Carlo simulations. This solution should prove useful for detailed studies of statistical and systematic errors in histogram reweighting.
In this paper, we provide the exact expression for the coefficients in the low-temperature series expansion of the partition function of the two-dimensional Ising model on the infinite square lattice. This is equivalent to exact determination of the number of spin configurations at a given energy. With these coefficients, we show that the ferromagnetic--to--paramagnetic phase transition in the square lattice Ising model can be explained through equivalence between the model and the perfect gas of energy clusters model, in which the passage through the critical point is related to the complete change in the thermodynamic preferences on the size of clusters. The combinatorial approach reported in this article is very general and can be easily applied to other lattice models.
The partition function of the two-dimensional Ising model on a square lattice with nearest-neighbour interactions and periodic boundary conditions is investigated. Kaufman [Phys. Rev. 76, 1232--1243 (1949)] gave a solution for this function consisting of four summands. The summands are rewritten as functions of a low-temperature expansion variable, resulting in polynomials with integer coefficients. Considering these polynomials for system sizes 2m×2n2^m\times 2^n2m×2n (m,n∈Nm,n\in\Nm,n∈N), a variety of recursion relations in m,nm,nm,n are found. The recursions reveal a rich structure of the partition function and can be employed to render the computer algebra calculation of the microcanonical partition function more efficient.
The partition function ZZZ of a two-dimensional Ising lattice is evaluated by expressing it in the form $Z=\ensuremath{\Sigma}{i}^{}\ensuremath{\lambda}_{i}^{}{}_{}{}^{\mathrm{nm}}$ where ${\ensuremath{\lambda}}_{i}$ are the eigenvalues of a 2n{2}^{n}2n-dimensional matrix M, nnn is the number of rows and mmm the number of columns of the lattice. M is a generalization of the V-shaped matrix studied by Kramers and Wannier in connection with the same problem. It is shown that M can be expressed in terms of 2n{2}^{n}2n-dimensional representations of 2n2n2n-dimensional orthogonal matrices. The eigenvalues of M are determined for nnn large by making use of the known relations between the eigenvalues of a 2n2n2n-dimensional orthogonal matrix and the eigenvalues of its 2n{2}^{n}2n-dimensional representative.The lattice considered differs only slightly from that treated by Onsager and Kaufman. In the lattice considered here, the boundary effects are eliminated by introducing an interaction between the last lattice point of each row and the first point of the next row. The matrix V considered by Onsager and Kaufman is, except for the boundary effects, equivalent to the matrix Mn{\mathbf{M}}^{n}Mn. ZZZ is shown to differ from the partition function calculated by Onsager and Kaufman only in order ${n}^{\ensuremath{-}2}$.
An analytical expression for the partition function of the 3-dimensional Ising Model is obtained (see formula (32)). It is approximate, but has several rational features: (1) It is valid on the whole temperature range from zero to infinity and has only one singular point at uc = 0.2612 in comparision to 0.22 from the series expan-sion; (2) It leads to a nonlogarithmic singularity for the specific heat; (3) It can be reduced into the exact Onsager 2-dimensional solution for planar rectangle lattice in the anisotropic case (see formula (34)) ; (4) It has a high temperature expansion, the first two coefficients are correct and the higher ones diminish systematically but remain positive.
Low-temperature expansion of Ising model has long been a topic of significant interest in condensed matter and statistical physics. In this paper we present new results of the coefficients in the low-temperature series of the Ising partition function on the square lattice, in the cases of a zero field and of an imaginary field $i(\ensuremath{\pi}/2){k}_{B}T$. The coefficients in the low-temperature series of the free energy in the thermodynamic limit are represented using the explicit expression of the density function of the Fisher zeros. The asymptotic behavior of the sequence of the coefficients when the order goes to infinity is determined exactly, for both the series of the free energy and of the partition function. Our analytic and numerical results demonstrate that the convergence radius of the sequence is dependent on the accumulation points of the Fisher zeros, which have the smallest modulus. In the zero field case this accumulation point is the physical critical point, while in the imaginary field case it corresponds to a nonphysical singularity. We further discuss the relation between the series coefficients and the energy state degeneracies, using the combinatorial expression of the coefficients and the subgraph expansion.