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Energy density correlations in the three-dimensional Ising model

Reginald Rutherford

Published Jan 1, 1973• 0 citations
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Abstract

The energy-density-energy-density correlation function is studied in the three-dimensional Ising model in zero external field, for various spins on the fcc lattice. An extension of the linked-cluster technique is used to obtain high-temperature series expansions for the correlation function and its associated functions, to at least eighth order in the high-temperature interaction variable. Analysis of the series provides values for their critical indices and amplitudes. These values are used to verify the predictions of several theories of critical behavior. The critical index of the coherence length of the energy density correlation function is found to be equal to that of the spin-spin correlation function for all spins within the accuracy obtained here. For spins higher than ~ this critical index appears to obey strong scaling. An analysis of universality indicates that only one scale factor is needed to transform the energy density correlation function from one spin to another. This prediction is checked here and found to be good within our present accuracy. The current-algebra hypothesis predicts definite relations between the leading singularities of various correlation functions at the critical point. This prediction is checked directly and consistent values of the leading coefficients are obtained. The shape of the energy density correlation function at large distances from the origin, both at and above the critical point, is determined. The results are sufficiently accurate to rule out the Ornstein-Zernike form in zero field for T > T , but not sufficient to eliminate the possibility c of anisotropy at T = T .

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Physical review. B, Solid state•Apr 1, 1972•56 citations
The energy-density-energy-density correlation function is studied in the three-dimensional Ising model in zero external field, for various spins on the fcc lattice. An extension of the linked-cluster technique is used to obtain high-temperature series expansions for the correlation function and its associated functions, to at least eighth order in the high-temperature interaction variable. Analysis of the series provides values for their critical indices and amplitudes. These values are used to verify the predictions of several theories of critical behavior. The critical index of the coherence length of the energy density correlation function is found to be equal to that of the spin-spin correlation function for all spins within the accuracy obtained here. For spins higher than ~ this critical index appears to obey strong scaling. An analysis of universality indicates that only one scale factor is needed to transform the energy density correlation function from one spin to another. This prediction is checked here and found to be good within our present accuracy. The current-algebra hypothesis predicts definite relations between the leading singularities of various correlation functions at the critical point. This prediction is checked directly and consistent values of the leading coefficients are obtained. The shape of the energy density correlation function at large distances from the origin, both at and above the critical point, is determined. The results are sufficiently accurate to rule out the Ornstein-Zernike form in zero field for T > T , but not sufficient to eliminate the possibility c of anisotropy at T = T .
High-temperature series for the inverse spin-spin correlation function of the s=12s=\frac{1}{2}s=21​ Ising ferromagnet are presented for the three cubic lattices. Series are tabulated to twelfth order in $K=\ensuremath{\beta}J$ in zero magnetic field and to eighth order in finite field. Direct series expansions for the true correlation length are derived. The critical correlations are analyzed for scaling behavior in both position and momentum space. The critical amplitudes which characterize the correlations both at Tc{T}_{c}Tc​ and in the Ornstein---Zernike region are determined. The Fisher---Burford scattering approximant is found to be consistent with the data. Finally, the consequences of the universality hypothesis are formulated for the correlations. Correlation-amplitude data for the three cubic lattices are shown to be in remarkable agreement with a formulation of universality which requires that the free energy in a region of diameter given by the coherence length be scale independent.
High-temperature series expansions for the Ising model's spin-spin correlation function are found to order (JkT)12{(\frac{J}{\mathrm{kT}})}^{12}(kTJ​)12 on the simple cubic, bcc, and fcc latices. Analysis of moment series indicates that the scaling form of the correlation function is correct, at least in the limit $\ensuremath{\kappa}r$ fixed, $\ensuremath{\kappa}\ensuremath{\rightarrow}0$. Values are obtained for the correlation indices $\ensuremath{\nu}$ and $\ensuremath{\eta}$-the latter by two methods, thereby providing a direct check on the scaling law.
Using the vertex renormalized form of the technique developed by Englert,1 high-temperature series expansions for the spin-spin correlation function of the classical anisotropic Heisenberg model are calculated for various lattices and anisotropies through order T−8 (close-packed lattices) and T−9 (loose-packed lattices). These series are combined and then extrapolated to give the high-temperature critical indices γ (zero-field susceptibility), ν (correlation range), and α (specific heat) as functions of anisotropy. The results are consistent with the hypothesis that the critical indices only change when there is a change in the symmetry of the system, e.g., in interpolating between the Ising and isotropic Heisenberg models, indices remain Ising-like until the system becomes isotropic, at which point they appear to change discontinuously. Previous results for the limiting cases are confirmed and extended. Series for the limiting cases (spin-infinity Ising, XY and isotropic Heisenberg models) as well as for the spin-½ Ising model2 have been derived for the B-site spinel lattice. Analysis of these series shows that the anomalies in the critical indices, reported on the basis of six-term expansions,3 disappear with the use of longer series.
Power-series expansions of the spin-pair correlation functions of the square, sc, and bcc Ising lattices have been obtained using the semi-invariant approach for general field HHH and temperature TTT. In three dimensions P\'ade-approximant analyses indicate $2{v}^{\ensuremath{'}}=1.285\ifmmode\pm\else\textpm\fi{}0.020$, in agreement with scaling, but $2{v}^{c}\ensuremath{\simeq}0.835\ifmmode\pm\else\textpm\fi{}0.02$ which is some (1-3)% above the scaling prediction ${v}^{c}=\frac{v}{\ensuremath{\beta}\ensuremath{\delta}}\ensuremath{\simeq}0.823$. However, ratio techniques reveal that this discrepancy can be attributed to significant confluent critical singularities. Cubic and quintic parametric representations of the critical equation of state, and corresponding expressions for the correlation length, ${\ensuremath{\xi}}_{1}(H, T)$, are developed, which are considerable improvements over the linear model. The universality and spherical symmetry of the critical scattering intensity $\stackrel{^}{\ensuremath{\chi}}(\stackrel{\ensuremath{\rightarrow}}{\mathrm{k}}, H, T)$ is confirmed to within (1-2)% by estimating suitable invariant combinations of amplitudes. The deviations from Ornstein-Zernike theory for general HHH and TTT are found to be considerably greater than for H=0H=0H=0, T>TcT>{T}_{c}T>Tc​. Complete parametric scaling representations of $\stackrel{^}{\ensuremath{\chi}}(\stackrel{\ensuremath{\rightarrow}}{\mathrm{k}}, H, T)$ are developed for three dimensions; corresponding scaling approximants are constructed in two dimensions but only for T=TcT={T}_{c}T=Tc​ and for $T\ensuremath{\gtrless}{T}_{c}$ with H=0H=0H=0.
High-temperature series expansions are used to test the reduction hypothesis of Kadanoff's operator algebra for the three-dimensional fcc Ising model with spin $s=\frac{3}{2},2,\ensuremath{\infty}$. Agreement with our data is convincing. Numerical values are given for the coupling coefficients between the order parameter $\ensuremath{\mu}$ and ${\ensuremath{\mu}}^{3}$ and between between ${\ensuremath{\mu}}^{2}$ and the local energy density.
High-temperature series expansions are used to examine the dependence of critical-point exponents upon lattice anisotropy (different interaction strengths in different directions in the lattice). The two-spin correlation function ${C}_{2}(\stackrel{\ensuremath{\rightarrow}}{\mathrm{r}})$ is calculated to tenth order in (1kBT\frac{1}{{k}_{B}T}kB​T1​) for the Ising Hamiltonian ${\mathcal{H}}_{l \mathrm{anis}}=\ensuremath{-}{J}_{\mathrm{xy}}\ensuremath{\Sigma}\stackrel{\mathrm{xy}}{〈\mathrm{ij}〉}{S}_{i}^{z}{S}_{j}^{z}\ensuremath{-}{J}_{z}\ensuremath{\Sigma}\stackrel{z}{〈\mathrm{ij}〉}{S}_{i}^{z}{S}_{j}^{z}$ for a wide range of anisotropy parameters $R\ensuremath{\equiv}\frac{{J}_{z}}{{J}_{\mathrm{xy}}}$ and for both the sc and fcc lattices; here the first summation is over all pairs of nearest-neighbor sites whose relative displacement vector ${\stackrel{\ensuremath{\rightarrow}}{\mathrm{r}}}_{\mathrm{ij}}$ has no zzz component, while the second summation is over all other pairs of nearest-neighbor sites. Hence for R=0R=0R=0, both the sc and fcc lattices reduce to the two-dimensional square lattice, while in the limit $R\ensuremath{\rightarrow}\ensuremath{\infty}$, the sc becomes a one-dimensional linear chain and the fcc becomes two noninteracting three-dimensional bcc lattices. The series for ${C}_{2}(\stackrel{\ensuremath{\rightarrow}}{\mathrm{r}})$ are then used to obtain series of corresponding lengths for the specific heat, susceptibility, and second moment. Analysis of these series yields results consistent with the universality hypothesis of critical-point exponents. Specifically, it is found that when lattice anisotrophy is introduced, the critical-point exponents studied (the susceptibility exponent $\ensuremath{\gamma}$ and the correlation length exponent $\ensuremath{\nu}$) do not appear to change from their values for an isotropic lattice. The problem of next-nearest-neighbor interactions is treated using similar methods in Paper II of this series (and briefly discussed in this paper).