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Physical review. B, Condensed matter

Susceptibilities of one-dimensional quantum spin models at zero temperature

Gerhard H. Muller, Robert E. Shrock

Published Nov 1, 1984• 19 citations
Publisher

Abstract

We calculate precise numerical values for the nondivergent direct or staggered zero-temperature susceptibilities of the one-dimensional, $S=\frac{1}{2}$, transverse Ising model at the critical field and for the isotropic $\mathrm{XY}$ model in zero field which have not been previously determined analytically. Our method is based on a rigorous approach to calculate dynamic correlation functions for these models. We also investigate the exact nature of the divergenices in the $q$-dependent susceptibilities. Our results are compared with existing predictions of approximate analytic approaches and numerical finite-chain calculations. Our result for the $\mathrm{XY}$ case is directly relevant for the interpretation of recent susceptibility measurements on the quasi-one-dimensional magnetic compound ${\mathrm{Cs}}_{2}$${\mathrm{CoCl}}_{4}$.

DOI
10.1103/physrevb.30.5254

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Based on the obtained exact results we systematically study the quench dynamics of a one-dimensional spin-1/2 transverse field Ising model with zero- and finite-temperature initial states. We focus on the magnetization of the system after a sudden change of the external field and a coherent time-evolution process. With a zero-temperature initial state, the quench magnetic susceptibility as a function of the initial field strength exhibits strongly similar scaling behaviors to those of the static magnetic susceptibility, and the quench magnetic susceptibility as a function of the final field strength shows a discontinuity at the quantum critical point. This discontinuity remains robust and always occurs at the quantum critical point even for the case of finite-temperature initial systems, which indicates a great advantage of employing quench dynamics to study quantum phase transitions.

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We calculate precise numerical values for the nondivergent direct or staggered zero-temperature susceptibilities of the one-dimensional, S=12S=\frac{1}{2}S=21​, transverse Ising model at the critical field and for the isotropic XY\mathrm{XY}XY model in zero field which have not been previously determined analytically. Our method is based on a rigorous approach to calculate dynamic correlation functions for these models. We also investigate the exact nature of the divergenices in the qqq-dependent susceptibilities. Our results are compared with existing predictions of approximate analytic approaches and numerical finite-chain calculations. Our result for the XY\mathrm{XY}XY case is directly relevant for the interpretation of recent susceptibility measurements on the quasi-one-dimensional magnetic compound {\mathrm{Cs}}_{2}$${\mathrm{CoCl}}_{4}.
We calculate the zero-temperature q-dependent susceptibilities of the one-dimensional, S=1/2, transverse Ising model at the critical magnetic field and of the isotropic XY model in zero field which have not been previously determined. Our method, which is based on a rigorous method of calculating dynamic correlation functions for these models, provides precise numerical values for the susceptibilities at wave numbers q=k\ensuremath{\pi}/M for integral M and odd integral k, as well as exact analytic results for the dominant singularities at q=0 and q=\ensuremath{\pi}.
We present new results on the time-dependent correlation functions Ξn(t) =4〈Sξ0(t)Sξn〉, ξ=x,y at zero temperature of the one-dimensional S=1/2 isotropic XY model (h=γ=0) and of the transverse Ising model (TI) at the critical magnetic field (h=γ=1). Both models are characterized by special cases of the Hamiltonian H=−J∑l[(1+γ)SxlSxl+1 +(1−γ)SylSyl+1 +hSzl]. We have derived exact results on the long-time asymptotic expansions of the autocorrelation functions (ACF’s) Ξ0(t) and on the singularities of their frequency-dependent Fourier transforms Φξξ0(ω). We have also determined the latter functions by high-precision numerical calculations. The functions Φξξ0(ω), ξ=x,y have singularities at the infinite sequence of frequencies ω=mω0, m=0, 1, 2, 3, ... where ω0=J for the XY model and ω0=2J for the TI model. In both models the singularities in Φxx0 (ω) for m=0, 1 are divergent, whereas the nonanalyticities at higher frequencies become increasingly weaker. We point out that the nonanalyticities at ω≠0 are intrinsic features of the discrete quantum chain and have therefore not been found in the context of a continuum analysis.
We present new results on the time-dependent correlation functions ${\ensuremath{\Xi}}_{n}(t)=4〈{S}_{0}^{\ensuremath{\xi}}(t){S}_{n}^{\ensuremath{\xi}}〉$, $\ensuremath{\xi}=x,y$, at zero temperature of the one-dimensional S=12S=\frac{1}{2}S=21​ isotropic XY\mathrm{XY}XY model ($h=\ensuremath{\gamma}=0$) and of the transverse Ising (TI) model at the critical magnetic field ($h=\ensuremath{\gamma}=1$). Both models are characterized by special cases of the Hamiltonian $H=\ensuremath{-}J\ensuremath{\Sigma}{l}^{}[(1+\ensuremath{\gamma}){S}_{l}^{x}{S}_{l+1}^{x}+(1\ensuremath{-}\ensuremath{\gamma}){S}_{l}^{y}{S}_{l+1}^{y}+h{S}_{1}^{z}]$. We have derived exact results on the long-time asymptotic expansions of the autocorrelation functions ${\ensuremath{\Xi}}_{0}(0)$ and on the singularities of their frequency-dependent Fourier transforms ${\ensuremath{\Phi}}_{0}^{\ensuremath{\xi}\ensuremath{\xi}}(\ensuremath{\omega})$. We have also determined the latter functions by high-precision numerical calculations. The functions ${\ensuremath{\Phi}}_{0}^{\ensuremath{\xi}\ensuremath{\xi}}(\ensuremath{\omega})$, $\ensuremath{\xi}=x,y$, have singularities at the infinite sequence of frequencies $\ensuremath{\omega}=m{\ensuremath{\omega}}_{0}$, m=0,1,2,3,…m=0,1,2,3,\dots{}m=0,1,2,3,…, where ${\ensuremath{\omega}}_{0}=J$ for the XY\mathrm{XY}XY model and ${\ensuremath{\omega}}_{0}=2J$ for the TI model. In the TI case, the leading singularities in ${\ensuremath{\varphi}}_{0}^{\mathrm{xx}}(\ensuremath{\omega})$ are alternately one-sided and two-sided power-law singularities, the first two of which (at $\ensuremath{\omega}=0,2J$) are divergent. The dominant singularities in the XY\mathrm{XY}XY case are alternate one-sided power laws and two-sided power laws with logarithmic corrections, the first two of which (at $\ensuremath{\omega}=0,J$) are divergent. The singularities at higher frequencies in both models are finite and become increasingly weaker. We point out that the nonanalyticities at $\ensuremath{\omega}\ensuremath{\ne}0$ are intrinsic features of the discrete quantum chain and have therefore not been found in the context of a continuum analysis (Luttinger model). At least the most prominent features of our new results should be observable in low-temperature dynamical experiments on quasi-one-dimensional compounds such as the XY\mathrm{XY}XY-like substances Cs2{\mathrm{Cs}}_{2}Cs2​CoCl4{\mathrm{Cl}}_{4}Cl4​ and PrCl3{\mathrm{Cl}}_{3}Cl3​ and the S=12S=\frac{1}{2}S=21​ Ising-like substance CsCoCl3{\mathrm{Cl}}_{3}Cl3​${\mathrm{\ifmmode\cdot\else\textperiodcentered\fi{}}2\mathrm{H}}_{2}$O.
We show that the zero-temperature susceptibility of the one-dimensional, dimerized Hubbard model at quarter-filling can be accurately determined on the basis of exact diagonalization of small clusters. The best procedure is to perform a finite-size scaling of the spin velocity ${\mathit{u}}_{\mathrm{\ensuremath{\sigma}}}$, and to calculate the susceptibility from the Luttinger-liquid relation \ensuremath{\chi}=2/\ensuremath{\pi}${\mathit{u}}_{\mathrm{\ensuremath{\sigma}}}$. We show that these results are reliable by comparing them with the analytical results that can be obtained in the weak- and strong-coupling limits. We have also used quantum Monte Carlo simulations to calculate the temperature dependence of the susceptibility for parameters that should be relevant to the Bechgaard salts. This shows that, used together, these numerical techniques are able to give precise estimates of the low-temperature susceptibility of realistic one-dimensional models of correlated electrons.
The paper presents a numerical approach for the calculation of thermodynamics and spin correlations for spin-½ XY chains. To illustrate the approach we performed exact finite-chain calculations of all time-dependent two-spin correlation functions for the spin-½ Ising chain in the transverse field. The computed correlation functions permit to evaluate the frequency-dependent susceptibilities and structure factors for this model. The obtained results are discussed in detail. They may have an application for the interpretation of dynamic experiments on quasi-one-dimensional crystals that can be treated within the frames of the spin-½ transverse Ising model.
Based on the obtained exact results we systematically study the quench dynamics of a one-dimensional spin-1/2 transverse field Ising model with zero- and finite-temperature initial states. We focus on the magnetization of the system after a sudden change of the external field and a coherent time-evolution process. With a zero-temperature initial state, the quench magnetic susceptibility as a function of the initial field strength exhibits strongly similar scaling behaviors to those of the static magnetic susceptibility, and the quench magnetic susceptibility as a function of the final field strength shows a discontinuity at the quantum critical point. This discontinuity remains robust and always occurs at the quantum critical point even for the case of finite-temperature initial systems, which indicates a great advantage of employing quench dynamics to study quantum phase transitions.