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Journal of Media Literacy Education

Dynamics of one-dimensional quantum spin systems with competing interactions at zero temperature

Yongmin Yu

Published Jan 1, 1996• 0 citations
Publisher

Abstract

This dissertation reports three projects on the zero-temperature dynamics of some prominent one-dimensional (1D) quantum spin systems. A common feature of all three model systems is the presence of competing interactions. Each project employs the recursion method in combination with recently developed techniques of continued-fraction analysis. The first model investigated is the 1D s = 1 XXZ model with an additional uniaxial single-site term. The results for the in-plane and out-of-plane spin dynamic structure factors $S\\sb{\\mu\\mu}(q,\\omega),\\ \\mu = x,\\ z$ are found to bear the characteristic signatures of several phase transitions between the Haldane phase, the Neel phase, the singlet phase, and two different critical phases. The second model investigated is the 1D s = 1/2 nearest-neighbor (nn) XXZ model with an additional isotropic next-nearest-neighbor (nnn) coupling. The focus here is on the dynamic structure factors $S\\sb{zz}(q,\\omega)$ and $S\\sb{DD}(q,\\omega$), which describe (for q = $\\pi$) the fluctuations of the Neel and dimer order parameters, respectively. By means of a weak-coupling continued-fraction analysis, the dependence on the exchange constants of the infrared exponent, the renormalized bandwidth of spinon excitations, and the spectral-weight distributions of S$\\sb{zz}(\\pi,\\omega$) and $S\\sb{DD}(\\pi,\\omega$) in the weak-coupling regime of the spin-fluid phase are calculated. For some parameter values, a discrete branch of excitations above the spinon continuum is found. The discrete states contribute to $S\\sb{zz}(q,\\omega$) but not to $S\\sb{DD}(q,\\omega$). A strong-coupling continued-fraction analysis is employed for the study of the dynamically relevant dispersions and spectral-weight distributions of $S\\sb{zz}(q,\\omega$) and $S\\sb{DD}(q,\\omega$) in the strong-coupling regime of the spin-fluid phase and in the dimer or Neel ordered phases. Special attention is given to the case where the pure dimer ground state is realized exactly. The third model investigated is the 1D s = 1 XXX model with bilinear and biquadratic exchange. Here the study is focused on the special coupling ratio where the valence-bond-solid ground state is realized. The excitation spectra which are dynamically relevant for the dynamic spill and dimer structure factors, $S\\sb{zz}(q,\\omega$) and $S\\sb{DD}(q,\\omega$), are investigated via two different types of continued-fraction analysis. The spectral weight in $S\\sb{ZZ}(q,\\omega$) is found to be carried predominantly by a single branch of quasi-particles and a continuum of two-particle scattering states thereof, whereas the spectral weight in $S\\sb{DD}(q,\\omega$) is dominated by the continuum alone, which shrinks to a single mode at $q = \\pi$.

DOI
10.23860/diss-4115

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This dissertation reports three projects on the zero-temperature dynamics of some prominent one-dimensional (1D) quantum spin systems. A common feature of all three model systems is the presence of competing interactions. Each project employs the recursion method in combination with recently developed techniques of continued-fraction analysis. The first model investigated is the 1D s = 1 XXZ model with an additional uniaxial single-site term. The results for the in-plane and out-of-plane spin dynamic structure factors Ssbmumu(q,omega),mu=x,zS\\sb{\\mu\\mu}(q,\\omega),\\ \\mu = x,\\ zSsbmumu(q,omega),mu=x,z are found to bear the characteristic signatures of several phase transitions between the Haldane phase, the Neel phase, the singlet phase, and two different critical phases. The second model investigated is the 1D s = 1/2 nearest-neighbor (nn) XXZ model with an additional isotropic next-nearest-neighbor (nnn) coupling. The focus here is on the dynamic structure factors Ssbzz(q,omega)S\\sb{zz}(q,\\omega)Ssbzz(q,omega) and SsbDD(q,omegaS\\sb{DD}(q,\\omegaSsbDD(q,omega), which describe (for q = pi\\pipi) the fluctuations of the Neel and dimer order parameters, respectively. By means of a weak-coupling continued-fraction analysis, the dependence on the exchange constants of the infrared exponent, the renormalized bandwidth of spinon excitations, and the spectral-weight distributions of Ssbzz(pi,omega\\sb{zz}(\\pi,\\omegasbzz(pi,omega) and SsbDD(pi,omegaS\\sb{DD}(\\pi,\\omegaSsbDD(pi,omega) in the weak-coupling regime of the spin-fluid phase are calculated. For some parameter values, a discrete branch of excitations above the spinon continuum is found. The discrete states contribute to Ssbzz(q,omegaS\\sb{zz}(q,\\omegaSsbzz(q,omega) but not to SsbDD(q,omegaS\\sb{DD}(q,\\omegaSsbDD(q,omega). A strong-coupling continued-fraction analysis is employed for the study of the dynamically relevant dispersions and spectral-weight distributions of Ssbzz(q,omegaS\\sb{zz}(q,\\omegaSsbzz(q,omega) and SsbDD(q,omegaS\\sb{DD}(q,\\omegaSsbDD(q,omega) in the strong-coupling regime of the spin-fluid phase and in the dimer or Neel ordered phases. Special attention is given to the case where the pure dimer ground state is realized exactly. The third model investigated is the 1D s = 1 XXX model with bilinear and biquadratic exchange. Here the study is focused on the special coupling ratio where the valence-bond-solid ground state is realized. The excitation spectra which are dynamically relevant for the dynamic spill and dimer structure factors, Ssbzz(q,omegaS\\sb{zz}(q,\\omegaSsbzz(q,omega) and SsbDD(q,omegaS\\sb{DD}(q,\\omegaSsbDD(q,omega), are investigated via two different types of continued-fraction analysis. The spectral weight in SsbZZ(q,omegaS\\sb{ZZ}(q,\\omegaSsbZZ(q,omega) is found to be carried predominantly by a single branch of quasi-particles and a continuum of two-particle scattering states thereof, whereas the spectral weight in SsbDD(q,omegaS\\sb{DD}(q,\\omegaSsbDD(q,omega) is dominated by the continuum alone, which shrinks to a single mode at q=piq = \\piq=pi.
We use the recursion method to study the spectral and dynamical properties of the one-dimensional (1D) s=1/2 XXZ method with planar anisotropy at T=0. Distinct methods of continued-fraction analysis have been developed for the weak-coupling and strong-coupling regimes of the corresponding lattice fermion system. The weak-coupling analysis presented here yields detailed information on the spectral-weight distribution in dynamic structure factors and spin autocorrelation functions, notably on the infrared singularities produced by critical fluctuations, and on the bound states for the case of attractive fermion interaction. The same method is then applied to the charge dynamics of the 1D t-J model for strongly correlated electrons. There it yields similar yet distinct results in the regime of weak exchange coupling. The results for renormalized bandwidths of particle-hole excitations are consistent with available results for charge velocities, and the results for the infrared exponent in the charge dynamic structure factor agree with existing results for the exponent of the equal-time charge correlation function.
This dissertation reports the results of three loosely connected research projects. Each project employs the recursion method in combination with recently developed techniques of continued-fraction analysis for the investigation of the dynamical properties at zero temperature of a particular quantum many-body system, including models of localized electron spins and models of strongly correlated itinerant electrons. We have studied these four models: two-dimensional (2D) s = 1/2 Heisenberg antiferromagnet (square lattice), the 2D s = 1/2 Heisenberg model with competing nearest-neighbor (Jsb1J\\sb1Jsb1) and next-nearest neighbor (Jsb2J\\sb2Jsb2) interactions, the 1D t-J model, and the 1D t-JsbzJ\\sb{z}Jsbz model.
The dynamical properties at T=0 of the one-dimensional (1D) s=1/2 nearest-neighbor (NN) XXZ model with an additional isotropic next-nearest-neighbor (NNN) coupling are investigated by means of the recursion method in combination with a weak-coupling continued-fraction analysis. The focus is on the dynamic structure factors Szz{\mathit{S}}_{\mathit{zz}}Szz​(q,\ensuremath{\omega}) and SDD{\mathit{S}}_{\mathit{DD}}SDD​(q,\ensuremath{\omega}), which describe (for q=\ensuremath{\pi}) the fluctuations of the N\'eel and dimer order parameters, respectively. We calculate the dependence on the exchange constants of the infrared exponent, the renormalized bandwidth of spinon excitations, and the spectral-weight distribution in Szz{\mathit{S}}_{\mathit{zz}}Szz​(\ensuremath{\pi},\ensuremath{\omega}) and SDD{\mathit{S}}_{\mathit{DD}}SDD​(\ensuremath{\pi},\ensuremath{\omega}), all in the spin-fluid phase, which is realized for planar NN anisotropy and sufficiently weak NNN coupling. For some parameter values we find a discrete branch of excitations above the spinon continuum. They contribute to Szz{\mathit{S}}_{\mathit{zz}}Szz​(q,\ensuremath{\omega}) but not to SDD{\mathit{S}}_{\mathit{DD}}SDD​(q,\ensuremath{\omega}). \textcopyright{} 1996 The American Physical Society.
For special coupling ratios, the one-dimensional (1D) s=1/2 Heisenberg model with antiferromagnetic nearest and next-nearest neighbor interactions has a pure dimer ground state, and the 1D s=1 Heisenberg model with antiferromagnetic bilinear and biquadratic interactions has an exact valence-bond-solid ground state. The recursion method is used to calculate the T=0 spin dynamic structure factor for both models and, for the s=1/2 model, also the dimer dynamic structure factor. New results for line shapes and dynamically relevant dispersions are obtained.
The recursion method is applied to the T=0 dynamics of the S=1/2 XXZ model on a linear chain and a square lattice. By means of new calculational techniques for the analysis of the continued-fraction coefficients pertaining to specific dynamical quantities, we obtain reliable information on the type of ordering in the ground state, on the size of gaps in the dynamically relevant excitation spectrum, on the bandwidths of dominant structures in spectral densities, on the exponents of infrared singularities, and on the detailed shape of spectral-weight distributions. We investigate some characteristic properties of the dynamic structure factors ${\mathit{S}}_{\mathrm{\ensuremath{\mu}}\mathrm{\ensuremath{\mu}}}$(q,\ensuremath{\omega}) and the spin autocorrelation functions ${\mathit{S}}^{\mathrm{\ensuremath{\mu}}\mathrm{\ensuremath{\mu}}}$(\ensuremath{\omega})=${\mathit{N}}^{\mathrm{\ensuremath{-}}1}$ tsumq{sum}_{\mathbf{q}}sumq​${\mathit{S}}_{\mathrm{\ensuremath{\mu}}\mathrm{\ensuremath{\mu}}}$(q,\ensuremath{\omega}), specifically their dependence on the uniaxial anisotropy, i.e., on the parameter which controls the type of ordering and the amount of quantum fluctuations in the ground state. We find, for example, that the different degrees of ordering in the planar regime of the one-dimensional and two-dimensional systems (criticality versus antiferromagnetic long-range order) have characteristic signatures in the dynamical properties which are conspicuously displayed in our results.
Classical and quantum spin systems are widely used models in both experimental and theoretical condensed matter physics. In many materials, the electronic interactions can be difficult to model exactly. However, in some insulators (Mott insulators), the magnetic (spin) interactions can be captured well with spin-only models. Several models are studied in this thesis. First, I report the solution of a long-standing issue in a classical frustrated spin model (i.e., where the quantum effects are neglected and the complexity is due to competing interactions): the nature of the thermal phase transition to a stripe state in the two dimensional (2D) J1-J2 model. Here J1 and J2 are nearest- and next-nearest-neighbor couplings. Monte Carlo simulations with single-spin updates are used for the calculations, and an extended-ensemble method, a generalization of the Wang-Landau algorithm, is also developed and tested. I focus on the study of "weak universality" behavior (continuously varying critical exponents, with one of the exponents staying fixed), for which I show a correspondence with a known class of conformal field theories with charge c = 1. Next, moving to quantum spins, to shed light on magnetic systems studied experimentally and to investigate new types of quantum states of interest in developing theories of quantum magnetism, I study the S = 1/2 Heisenberg model on the 2D square lattice with added six-spin interactions (the so-called J-Q3 model) as well as a set of 3D quantum antiferromagnets on dimerized lattices. Here I use the stochastic series expansion quantum Monte Carlo method. In the study of the J-Q3 model, I report on a similar weak-universality behavior as in the classical J1-J2 model, but with a mapping to a different known class of c = 1 conformal field theories. The critical behavior of the system again shows continuously changing exponents, in a way which corresponds to a gradual weakening of Z4 symmetry-breaking to an emergent U(1) symmetry. In the study of dimerized antiferromagnets, I report on a universal behavior of the Néel temperature TN, which can be related to ground state parameters independently of the microscopic interaction details in several different models.