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Proceedings of the Physical Society

The Entropy of an Antiferromagnet in a Magnetic Field

Jill C. Bonner, Michael Ellis Fisher

Published Aug 1, 1962• 27 citations
Publisher

Abstract

The Ising model of an antiferromagnet exhibits an anomalous entropy peak at a critical magnetic field which remains even at the absolute zero of temperature, in violation of the third law of thermodynamics. By investigating numerically the behaviour of finite chains of spins interacting through the more general anisotropic Heisenberg coupling, described by the Hamiltonian provided it is shown that the zero point anomalous entropy is peculiar to the Ising model (γ = 0). If the anisotropy is sufficiently great, however, an appreciable entropy peak does persist down to low temperatures although in the anisotropic (pure Heisenberg) limit the entropy has only a broad maximum which falls steadily in height as T approaches zero.

DOI
10.1088/0370-1328/80/2/318

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Low-temperature thermodynamic properties of a random anisotropic antiferromagnetic chain

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Ising Model on Tangled Chain. I. Free Energy and Entropy

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Acta Physica Polonica A•Jun 1, 1994•3 citations
The Ising model of an antiferromagnet exhibits an anomalous entropy peak at a critical magnetic field which remains even at the absolute zero of temperature, in violation of the third law of thermodynamics. By investigating numerically the behaviour of finite chains of spins interacting through the more general anisotropic Heisenberg coupling, described by the Hamiltonian provided it is shown that the zero point anomalous entropy is peculiar to the Ising model (γ = 0). If the anisotropy is sufficiently great, however, an appreciable entropy peak does persist down to low temperatures although in the anisotropic (pure Heisenberg) limit the entropy has only a broad maximum which falls steadily in height as T approaches zero.
The low-temperature thermodynamic properties of a spin-\textonehalf{} one-dimensional random anisotropic (Heisenberg-Ising) antiferromagnet described by the Hamiltonian $H=\ensuremath{\Sigma}{i}^{}{J}_{i}({\ensuremath{\sigma}}_{x}^{i}{\ensuremath{\sigma}}_{x}^{i+1}+{\ensuremath{\sigma}}_{y}^{i}{\ensuremath{\sigma}}_{y}^{i+1}+\ensuremath{\gamma}{\ensuremath{\sigma}}_{z}^{i}{\ensuremath{\sigma}}_{z}^{i+1})$ are studied as a function of disorder and anisotropy. The Ji> 0{J}_{i}>~0Ji​> 0 are independent random variables obeying a probability distribution P(J)P(J)P(J), and $0<~\ensuremath{\gamma}<~\ensuremath{\infty}$. The approach used is a numerical implementation of a real-space renormalization-group (RG) method previously introduced. The isotropic Heisenberg case ($\ensuremath{\gamma}=1$), the XY\mathrm{XY}XY case ($\ensuremath{\gamma}=0$). and the Ising case ($\ensuremath{\gamma}=\ensuremath{\infty}$) are fixed points of the RG transformation. It is found that in the XY\mathrm{XY}XY region $\ensuremath{\gamma}<~1$, including the Heisenberg point, the system exhibits singular behavior in the thermodynamic properties for arbitrary probability distributions for the couplings. For the XY\mathrm{XY}XY limit ($\ensuremath{\gamma}=0$) this is in agreement with known exact results. The functional form for the low-temperature susceptibility is found to be $\ensuremath{\chi}\ensuremath{\sim}\frac{1}{(T{\mathrm{ln}}^{m}(\frac{T}{{T}_{0}}))}$ in the entire region $0<~\ensuremath{\gamma}<~1$ for arbitrary probability distributions. In the Ising region ($\ensuremath{\gamma}>1$) the susceptibility shows an approximate power-law divergence for small anisotropy but goes eventually to zero as $T\ensuremath{\rightarrow}0$. Possible relevance of these results to recent experiments on Qn(TCNQ)2{(\mathrm{TCNQ})}_{2}(TCNQ)2​ is discussed.
The anisotropic nearest-neighbour Heisenberg model for the simple cubic lattice has been investigated by interpolating the anisotropy between the Ising and isotropic Heisenberg limits via general spin high-temperature series expansions of the zero-field suspectibility. This is done by estimating the critical temperature (Tc(3)) and the susceptibility exponent γ from the analysis of the series by the Ratio and Pade approximants methods. It is noted that Tc(3) varies with anisotropy while γ is almost the same for the anisotropic system, and a jump in it occurs for the isotropic case in agreement with the universality hypothesis. The effect of anisotropy on the susceptibility is also shown. Further, it is seen that estimates of γ for the two extreme limits agree well with those of previous theoretical as well as experimental investigations. In addition, critical temperatures have been summarised in a relation, and expressions for the magnetisation have been derived.
Up to now, probing the quantum phase transition (QPT) and quantum critical (QC) phenomena at finite temperatures in one-dimensional (1D) spin systems still lacks an in-depth understanding. Herein, we study the QPT and thermodynamics of 1D spin-1/2 anisotropic Heisenberg antiferromagnetic chains by Green’s function theory. The quantum phase diagram is renormalized by the anisotropy (∆), which manifests a quantum critical point (QCP) hc = 1 + ∆ signaling the transition from gapless Tomonaga–Luttinger liquid (TLL) to gapped ferromagnetic (FM) state, demonstrated by the magnetic entropy and thermal Drude weight. At low temperatures, it is shown that two crossover temperatures fan out a QC regime and capture the QCP via the linear extrapolation to zero temperature. In addition, around QCP, the QC scaling is performed by analyzing the entropy and thermal Drude weight to extract the critical exponents (α, δ, and β) that fulfill the Essamm–Fisher scaling law, which provides a novel thermodynamic means to detect QPT for experiment. Furthermore, scaling hypothesis equations with two rescaled manners are proposed to testify the scaling analysis, for which all the data points fall on a universal curve or two independent branches for the plot against rescaled field or temperature, implying the self-consistency and reliability of the obtained critical exponents.
The anisotropic Heisenberg model has been investigated by interpolating anisotropy between the Ising and isotropic Heisenberg limits via general spin high temperature series (HTS) for the zero-field susceptibility of the ferromagnets for the square lattice. This is done by locating the critical temperature ( T c (2) ) and the susceptibility exponent (γ) from the analysis of the series by Pade approximant and ratio methods. The critical temperature is found to be spin dependent. It decreases as anisotropy changes from the Ising limit towards the isotropic limit and remains finite (lower than that of Stanley and Kaplan) for all the spins except for S =1/2 at the isotropic limit. Exponent γ is almost Ising like for the anisotropic system and anomalous jump in it occurs for the isotropic case. In addition, expressions for the magnetization are derived by using spin-wave theory. The limit of complete isotropy has been found not to be a special case for the susceptibility, in contrast to magnetization.
The antiferromagnetic ${J}_{1}\ensuremath{-}{J}_{2}$ model is a spin-1/2 chain with isotropic exchange J1>0{J}_{1}>0J1​>0 between first neighbors and ${J}_{2}=\ensuremath{\alpha}{J}_{1}$ between second neighbors. The model supports both gapless quantum phases with nondegenerate ground states and gapped phases with $\mathrm{\ensuremath{\Delta}}(\ensuremath{\alpha})>0$ and doubly degenerate ground states. Exact thermodynamics is limited to $\ensuremath{\alpha}=0$, the linear Heisenberg antiferromagnet (HAF). Exact diagonalization of small systems at frustration $\ensuremath{\alpha}$ followed by density matrix renormalization group calculations returns the entropy density $S(T,\ensuremath{\alpha},N)$ and magnetic susceptibility $\ensuremath{\chi}(T,\ensuremath{\alpha},N)$ of progressively larger systems up to N=96N=96N=96 or 152 spins. Convergence to the thermodynamic limit, $S(T,\ensuremath{\alpha})$ or $\ensuremath{\chi}(T,\ensuremath{\alpha})$, is demonstrated down to $T/J\ensuremath{\sim}0.01$ in the sectors $\ensuremath{\alpha}<1$ and $\ensuremath{\alpha}>1$. $S(T,\ensuremath{\alpha})$ yields the critical points between gapless phases with ${S}^{\ensuremath{'}}(0,\ensuremath{\alpha})>0$ and gapped phases with ${S}^{\ensuremath{'}}(0,\ensuremath{\alpha})=0$. The ${S}^{\ensuremath{'}}(T,\ensuremath{\alpha})$ maximum at ${T}^{*}(\ensuremath{\alpha})$ is obtained directly in chains with large $\mathrm{\ensuremath{\Delta}}(\ensuremath{\alpha})$ and by extrapolation for small gaps. A phenomenological approximation for $S(T,\ensuremath{\alpha})$ down to T=0T=0T=0 indicates power-law deviations ${T}^{\ensuremath{-}\ensuremath{\gamma}(\ensuremath{\alpha})}$ from $exp[\ensuremath{-}\mathrm{\ensuremath{\Delta}}(\ensuremath{\alpha})/T]$ with exponent $\ensuremath{\gamma}(\ensuremath{\alpha})$ that increases with $\ensuremath{\alpha}$. The $\ensuremath{\chi}(T,\ensuremath{\alpha})$ analysis also yields power-law deviations, but with exponent $\ensuremath{\eta}(\ensuremath{\alpha})$ that decreases with $\ensuremath{\alpha}$. Spin correlation functions account for $S(T,\ensuremath{\alpha})$ differences between frustration $\ensuremath{\alpha}<1$ within a chain and $\ensuremath{\alpha}>1$ between HAFs on sublattices. $S(T,\ensuremath{\alpha})$ and the spin density $\ensuremath{\rho}(T,\ensuremath{\alpha})=4T\ensuremath{\chi}(T,\ensuremath{\alpha})$ probe the thermal and magnetic fluctuations, respectively, of strongly correlated spin states. Gapless chains have constant $S(T,\ensuremath{\alpha})/\ensuremath{\rho}(T,\ensuremath{\alpha})$ for T<0.10T<0.10T<0.10. Remarkably, the ratio decreases (increases) with TTT in chains with large (small) $\mathrm{\ensuremath{\Delta}}(\ensuremath{\alpha})$.
In this paper we have considered an Ising model defined on tangled chain, in which more bonds have been added to those of pure Ising chain.To understand their competition, particularly between ferromagnetic and antiferromagnetic bonds, we have studied, using the transfer matrix method, some simple analytical calculations and an iterative algorithm, the behaviour of the free energy and entropy, particularly in the zero-field and zero-temperature limit, for different configurations of the ferromagnetic tangled chain and different types of additional interactions (ferromagnetic or antiferromagnetic).We found that the condition J = -J' between the ferromagnetic interaction J along the chain and the antiferromagnetic interaction J a l o n g the chain is somewhat as a "transition region" condition for this behaviour.Our results indicate also the existence of nonzero entropy at zero temperature.