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arXiv:0806.2100 · Physical Review B

(m,d,N)=(1,3,2) Lifshitz point and the three-dimensional XY universality class studied by high-temperature bivariate series for XY models with anisotropic competing interactions

P. Butera, M. Pernici

Published Aug 6, 2008• 9 citations
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Abstract

High-temperature bivariate expansions have been derived for the two-spin-correlation function in a variety of classical lattice $XY$ (planar rotator) models in which spatially isotropic interactions among first-neighbor spins compete with spatially isotropic or anisotropic (in particular uniaxial) interactions among next-to-nearest-neighbor spins. The expansions, calculated for cubic lattices of dimensions $d=1$, 2, and 3, are expressed in terms of the two variables ${K}_{1}={J}_{1}/kT$ and ${K}_{2}={J}_{2}/kT$, where ${J}_{1}$ and ${J}_{2}$ are the nearest-neighbor and the next-to-nearest-neighbor exchange couplings, respectively. This paper deals in particular with the properties of the $d=3$ uniaxial $XY$ model (ANNNXY model) for which the bivariate expansions have been computed through the 18th order, thus extending by 12 orders the results so far available and making a study of this model possible over a wide range of values of the competition parameter $R={J}_{2}/{J}_{1}$. Universality with respect to $R$ on the critical line separating the paramagnetic and the ferromagnetic phases can be verified, and at the same time the very accurate determination $\ensuremath{\gamma}=1.3177(5)$ and $\ensuremath{\nu}=0.6726(8)$ of the critical exponents of the susceptibility and of the correlation length, in the three-dimensional $XY$ universality class, can be achieved. For the exponents at the multicritical $(m,d,N)=(1,3,2)$ Lifshitz point the estimates ${\ensuremath{\gamma}}_{l}=1.535(25)$, ${\ensuremath{\nu}}_{\ensuremath{\perp}}=0.805(15)$, and ${\ensuremath{\nu}}_{\ensuremath{\parallel}}=0.40(3)$ are obtained. Finally, the susceptibility exponent is estimated along the boundary between the disordered and the modulated phases.

DOI
10.1103/physrevb.78.054405

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High-temperature bivariate expansions have been derived for the two-spin-correlation function in a variety of classical lattice XYXYXY (planar rotator) models in which spatially isotropic interactions among first-neighbor spins compete with spatially isotropic or anisotropic (in particular uniaxial) interactions among next-to-nearest-neighbor spins. The expansions, calculated for cubic lattices of dimensions d=1d=1d=1, 2, and 3, are expressed in terms of the two variables K1=J1/kT{K}_{1}={J}_{1}/kTK1​=J1​/kT and K2=J2/kT{K}_{2}={J}_{2}/kTK2​=J2​/kT, where J1{J}_{1}J1​ and J2{J}_{2}J2​ are the nearest-neighbor and the next-to-nearest-neighbor exchange couplings, respectively. This paper deals in particular with the properties of the d=3d=3d=3 uniaxial XYXYXY model (ANNNXY model) for which the bivariate expansions have been computed through the 18th order, thus extending by 12 orders the results so far available and making a study of this model possible over a wide range of values of the competition parameter R=J2/J1R={J}_{2}/{J}_{1}R=J2​/J1​. Universality with respect to RRR on the critical line separating the paramagnetic and the ferromagnetic phases can be verified, and at the same time the very accurate determination \ensuremathγ=1.3177(5)\ensuremath{\gamma}=1.3177(5)\ensuremathγ=1.3177(5) and \ensuremathν=0.6726(8)\ensuremath{\nu}=0.6726(8)\ensuremathν=0.6726(8) of the critical exponents of the susceptibility and of the correlation length, in the three-dimensional XYXYXY universality class, can be achieved. For the exponents at the multicritical (m,d,N)=(1,3,2)(m,d,N)=(1,3,2)(m,d,N)=(1,3,2) Lifshitz point the estimates \ensuremathγl=1.535(25){\ensuremath{\gamma}}_{l}=1.535(25)\ensuremathγl​=1.535(25), \ensuremathν\ensuremath⊥=0.805(15){\ensuremath{\nu}}_{\ensuremath{\perp}}=0.805(15)\ensuremathν\ensuremath⊥​=0.805(15), and \ensuremathν\ensuremath∥=0.40(3){\ensuremath{\nu}}_{\ensuremath{\parallel}}=0.40(3)\ensuremathν\ensuremath∥​=0.40(3) are obtained. Finally, the susceptibility exponent is estimated along the boundary between the disordered and the modulated phases.
The bivariate high-temperature expansion of the spin-spin correlation function of the three-dimensional classical XYXYXY (planar rotator) model, with spatially anisotropic nearest-neighbor couplings, is extended from the tenth through the 21st order. The computation is carried out for the simple cubic lattice, in the absence of magnetic field, in the case in which the coupling strength along the zzz axis of the lattice is different from those along the xxx and the yyy axes. It is then possible to determine accurately the critical temperature as function of the parameter RRR which characterizes the coupling anisotropy and to check numerically the universality, with respect to RRR, of the critical exponents of the three-dimensional anisotropic system. The analysis of our data also shows that the main predictions of the generalized scaling theory for the crossover from the three-dimensional to the two-dimensional critical behavior are compatible with the series extrapolations.
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).
We have extended through ${\ensuremath{\beta}}^{23}$ the high-temperature expansion of the second field derivative of the susceptibility for Ising models of general spin, with nearest-neighbor interactions, on the simple cubic and the body-centered cubic lattices. Moreover, the expansions for the nearest-neighbor correlation function, the susceptibility, and the second correlation moment have been extended up to ${\ensuremath{\beta}}^{25}.$ Taking advantage of these new data, we can improve the accuracy of direct estimates of critical exponents and of hyperuniversal combinations of critical amplitudes such as the renormalized four-point coupling gr{g}_{r}gr​ or the quantity usually denoted by ${R}_{\ensuremath{\xi}}^{+}.$ In particular, we obtain $\ensuremath{\gamma}=1.2371(1),$ $\ensuremath{\nu}=0.6299(2),$ ${\ensuremath{\gamma}}_{4}=4.3647(20),$ gr=1.404(3),{g}_{r}=1.404(3),gr​=1.404(3), and ${R}_{\ensuremath{\xi}}^{+}=0.2668(5).$ We have used a variety of series extrapolation procedures and, in some of the analyses, we have assumed that the leading correction-to-scaling exponent $\ensuremath{\theta}$ is universal and roughly known. We have also verified, to high precision, the validity of the hyperscaling relation and of the universality property both with regard to the lattice structure and to the value of the spin.
High-temperature series expansions are used to examine the dependence of critical-point exponents upon the presence of second-neighbor interactions. We consider the Hamiltonian ${\mathcal{H}}_{\mathrm{nnn}}=\ensuremath{-}{J}_{1}\ensuremath{\Sigma}\stackrel{\mathrm{nn}}{〈\mathrm{ij}〉}{\stackrel{\ensuremath{\rightarrow}}{\mathrm{S}}}_{i}^{(D)}\ifmmode\cdot\else\textperiodcentered\fi{}{\stackrel{\ensuremath{\rightarrow}}{\mathrm{S}}}_{j}^{(D)}\ensuremath{-}{J}_{2}\ensuremath{\Sigma}\stackrel{\mathrm{nnn}}{〈\mathrm{ij}〉}{\stackrel{\ensuremath{\rightarrow}}{\mathrm{S}}}_{i}^{(D)}\ifmmode\cdot\else\textperiodcentered\fi{}{\stackrel{\ensuremath{\rightarrow}}{\mathrm{S}}}_{j}^{(D)},$ where the first and second sums are over pairs of nearest-neighbor (nn) and next-nearest-neighbor (nnn) sites, and where the spins ${\stackrel{\ensuremath{\rightarrow}}{\mathrm{S}}}^{(D)}$ are DDD-dimensional unit vectors. The two-spin correlation function, ${C}_{2}(\stackrel{\ensuremath{\rightarrow}}{\mathrm{r}})$, is calculated to tenth, ninth, and eighth order in 1kBT\frac{1}{{k}_{B}T}kB​T1​ for the Ising (D=1D=1D=1), classical-planar (D=2D=2D=2), and classical-Heisenberg (D=3D=3D=3) models, respectively, for various values of the parameter ${R}^{\ensuremath{'}}\ensuremath{\equiv}\frac{{J}_{2}}{{J}_{1}}$ and for various cubic lattices (fcc, bcc, and sample cubic). These represent the first series expansions of the spin correlation function for nnn interactions. From ${C}_{2}(\stackrel{\ensuremath{\rightarrow}}{\mathrm{r}})$ we obtain series for the specific heat, susceptibility, and second moment. Analysis of these series and detailed comparisons with the exactly soluble spherical model ($D=\ensuremath{\infty}$) lead us to conclude that the exponents $\ensuremath{\gamma}$ (susceptibility) and $\ensuremath{\nu}$ (correlation length) may be independent of ${R}^{\ensuremath{'}}$; this suggestion is consistent with the universality hypothesis.
We present the high-temperature series for a nearest-neighbor model with O(2) symmetry on a simple cubic lattice with the most general single-site potential. In particular, the magnetic susceptibility and the second-moment correlation length are computed to 22nd order. The series specialized to some particular improved Hamiltonians have been already analyzed in the paper M. Campostrini, M. Hasenbusch, A. Pelissetto, and E. Vicari, Phys. Rev. B 74, 144506 (2006) [cond-mat/0605083], to determine the critical exponents and other universal quantities of the three-dimensional XY universality class.
We study a generalized Blume-Capel model on the simple cubic lattice. In addition to the nearest-neighbor coupling there is a next-to-next-to-nearest-neighbor coupling. In order to quantify spatial anisotropy, we determine the correlation length in the high-temperature phase of the model for three different spatial directions. It turns out that the spatial anisotropy depends very little on the dilution or crystal-field parameter DDD of the model and is essentially determined by the ratio of the nearest-neighbor and the next-to-next-to-nearest-neighbor coupling. This ratio is tuned such that the leading contribution to the spatial anisotropy is eliminated. Next we perform a finite-size scaling (FSS) study to tune DDD such that also the leading correction to scaling is eliminated. Based on this FSS study, we determine the critical exponents $\ensuremath{\nu}=0.629\phantom{\rule{0.16em}{0ex}}98(5)$ and $\ensuremath{\eta}=0.0362\phantom{\rule{0.16em}{0ex}}84(40)$, which are in nice agreement with the more accurate results obtained by using the conformal bootstrap method. Furthermore, we provide accurate results for fixed-point values of dimensionless quantities such as the Binder cumulant and for the critical couplings. These results provide the groundwork for broader studies of universal properties of the three-dimensional Ising universality class.