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arXiv:cond-mat/9405043 · Physical review. B, Condensed matter

DynamicalT=0 correlations of theS=1/2 one-dimensional Heisenberg antiferromagnet with 1/ r2 exchange in a magnetic field

J. C. Talstra, F. D. M. Haldane

Published Sep 1, 1994• 29 citations
arXivHTMLPDF

Abstract

We present a selection rule for matrix elements of local spin operators in the S=1/2 Haldane-Shastry model. Based on this rule we extend a recent exact calculation by Haldane and Zirnbauer of the ground-state dynamical spin correlation function ${\mathit{S}}^{\mathit{a}\mathit{b}}$(n,t)=〈0\ensuremath{\Vert}${\mathit{S}}^{\mathit{a}}$(n,t)${\mathit{S}}^{\mathit{b}}$(0,0)\ensuremath{\Vert}0〉 and its Fourier transform ${\mathit{S}}^{\mathit{a}\mathit{b}}$(Q,E) of this model to a finite magnetic field. In zero field, only two-spinon excitations contribute to the spec tral function; in the (positively) partially spin-polarized case, there are two types of elementary excitations: spinons (\ensuremath{\Delta}${\mathit{S}}^{\mathit{z}}$=\ifmmode\pm\else\textpm\fi{}1/2) and magnons (\ensuremath{\Delta}${\mathit{S}}^{\mathit{z}}$=-1). The magnons are divided into left- or right-moving branches. The only classes of excited states contributing to the spectral functions are (I) two spinons, (II) two spinons+one magnon, (IIIa) two spinons+two magnons (moving in opposite directions), and (IIIb) one magnon. The contributions to the various correlations are ${\mathit{S}}^{\mathrm{\ensuremath{-}}+}$: (I); ${\mathit{S}}^{\mathit{z}\mathit{z}}$: (I)+(II); ${\mathit{S}}^{+\mathrm{\ensuremath{-}}}$: (I)+(II)+(III). In the zero-field limit there are no magnons, while in the fully polarized case, there are no spinons. We discuss the relation of the spectral functions to correlations of the Calogero-Sutherland model at coupling \ensuremath{\lambda}=2.

DOI
10.1103/physrevb.50.6889

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In this chapter, we discuss the static and dynamic properties of the spin chain which is often referred to as the Haldane–Shastry model [77, 161]. In contrast with more familiar spin chains with the nearest-neighbor exchange interaction, the Haldane–Shastry model has a particular form of the longrange exchange interaction. In spite of its peculiar shape, it has turned out that the Haldane–Shastry model is the most fundamental one-dimensional spin system. We shall start with a discussion of how the model is solved for the ground state in Sections 4.1 to 4.3, and proceed to static correlation functions in Sections 4.4 and 4.5. The excitation spectrum is interpreted by magnons in Section 4.6, and by spinons in Section 4.7. The spinon picture gives the correct degeneracy of the energy levels in Section 4.8, and leads to the derivation of thermodynamics in Section 2.4, and the dynamical correlation function in Section 4.11. Most results have been obtained in an analytic form without any approximation. There is a close connection between the spectrum of the spin chain and that of the Sutherland model. The most remarkable fact is that the spin chain has a correspondence with two different values of the coupling parameter λ in the Sutherland model. Namely, the spectrum is mapped to the case with either λ = 2 or λ = ∞. In the latter case, particles crystallize with equal spacing, and a small oscillation from the equilibrium, as well as exchange interactions, make up the spectrum. In both cases of λ, however, the degeneracy of each level in the spin chain is not reproduced. Hence, the mapping as it stands cannot be used for thermodynamics.
Spin-dynamical calculations on one-dimensional systems have relied heavily on classical ($s=\ensuremath{\infty}$) theories, despite abundant evidence that quantum effects can be extremely important at low temperatures. We present a new approach to the spin dynamics of the one-dimensional isotropic s=12s=\frac{1}{2}s=21​ Heisenberg antiferromagnetic (HB AF) which does not involve the many-body techniques usually employed. It is based on analytic Bethe ansatz calculations of excitation energies and densities of states combined with finite-chain calculations of matrix elements. An important feature of our method is the use of rigorous selection rules and the introduction of new selection rules, which are valid for macroscopic systems in a magnetic field. We show that in zero field the dynamical two-spin correlation function ${S}_{\ensuremath{\mu}\ensuremath{\mu}}(q,\ensuremath{\omega})$ at T=0T=0T=0 is governed by a two-parameter continuum of spin-wave-type excitations. In nonzero field, the longitudinal component ${S}_{\mathrm{zz}}(q,\ensuremath{\omega})$ and the transverse components ${S}_{\mathrm{xx}}(q,\ensuremath{\omega})\ensuremath{\equiv}{S}_{\mathrm{yy}}(q,\ensuremath{\omega})$ behave quite differently because they are dominated by different continua of excitations. The former is characterized by a lowest excitation branch with a zero-frequency mode moving from the zone boundary ($q=\ensuremath{\pi}$) towards the zone center (q=0q=0q=0) as the field increases, whereas the latter is characterized by a lowest branch with a zero frequency mode moving from $q=0 \mathrm{to} \ensuremath{\pi}$ with increasing field. The first part of our work features an approximate analytic expression for ${S}_{\ensuremath{\mu}\ensuremath{\mu}}(q,\ensuremath{\omega})$ at zero temperature and in zero field. Although our expression is not rigorous, exact sum rules are violated only by a small amount, and good agreement exists with the few known exact results. Our studies are extended to nonzero temperatures by placing major reliance on exact finite-chain calculations. Our work was stimulated by recent neutron scattering experiments and is oriented towards experimental comparisons. Our result for the s=12s=\frac{1}{2}s=21​ integrated intensity is in much better agreement with neutron scattering data on CuCl2{\mathrm{Cl}}_{2}Cl2​\ifmmode\cdot\else\textperiodcentered\fi{}2N(C5{\mathrm{C}}_{5}C5​D5{\mathrm{D}}_{5}D5​) (CPC) than the corresponding semiclassical result. Moreover, the spectral-weight distribution in ${S}_{\ensuremath{\mu}\ensuremath{\mu}}(q,\ensuremath{\omega})$ shows increasing asymmetry as $q\ensuremath{\rightarrow}\ensuremath{\pi}$, a quantum effect, again in agreement with more recent neutron scattering data. The second part of our work deals with the effects of an applied magnetic field. We extend the analytic work of Ishimura and Shiba to obtain expressions for the energies and densities of states of the various excitation continua. It is shown that these continua are expected to give rise to multiple structures in the scattering intensity. Our results appear to be in quantitative agreement with preliminary results of a neutron study in CPC in a field of 70 kOe, revealing anomalous scattering intensity peaks. Our results repeatedly demonstrate the inadequacy of classical spin-wave theory for this problem. They call for additional experimental studies on quasi-one-dimensional antiferromagnets to examine other unusual and interesting phenomena predicted by our approach.
The T=0T=0T=0 dynamical properties of the one-dimensional (1D) s=12s=\frac{1}{2}s=21​ Heisenberg antiferromagnet in a uniform magnetic field are studied via the Bethe ansatz for cyclic chains of N sites. The ground state at magnetization 0<Mz<N/2,0<{M}_{z}<N/2,0<Mz​<N/2, which can be interpreted as a state with 2Mz{2M}_{z}2Mz​ spinons or as a state of $N/2\ensuremath{-}{M}_{z}$ magnons, is reconfigured here as the vacuum for a different species of quasiparticles, the psinons and antipsinons. We investigate three kinds of quantum fluctuations, namely the spin fluctuations parallel and perpendicular to the direction of the applied magnetic field and the dimer fluctuations. The dynamically dominant excitation spectra are found to be sets of collective excitations composed of two quasiparticles excited from the psinon vacuum in different configurations. The Bethe ansatz provides a framework for (i) the characterization of the new quasiparticles in relation to the more familiar spinons and magnons, (ii) the calculation of spectral boundaries and densities of states for each continuum, (iii) the calculation of transition rates between the ground state and the dynamically dominant collective excitations, (iv) the prediction of line shapes for dynamic structure factors relevant for experiments performed on a variety of quasi-1D antiferromagnetic compounds, including KCuF3,{\mathrm{KCuF}}_{3},KCuF3​, Cu(C4H4N2)(NO3)2,\mathrm{Cu}({\mathrm{C}}_{4}{\mathrm{H}}_{4}{\mathrm{N}}_{2})({\mathrm{NO}}_{3}{)}_{2},Cu(C4​H4​N2​)(NO3​)2​, and CuGeO3.{\mathrm{CuGeO}}_{3}.CuGeO3​.
The spin fluctuations parallel to the external magnetic field in the ground state of the one-dimensional (1D) s=12s=\frac{1}{2}s=21​ Heisenberg antiferromagnet are dominated by a two-parameter set of collective excitations. In a cyclic chain of N sites and magnetization 0<Mz<N/2,0<{M}_{z}<N/2,0<Mz​<N/2, the ground state, which contains 2Mz{2M}_{z}2Mz​ spinons, is reconfigured as the physical vacuum for a different species of quasiparticles, identifiable in the framework of the coordinate Bethe ansatz by characteristic configurations of Bethe quantum numbers. The dynamically dominant excitations are found to be scattering states of two such quasiparticles. For $\stackrel{\ensuremath{\rightarrow}}{N}\ensuremath{\infty},$ these collective excitations form a continuum in $(q,\ensuremath{\omega})$ space with an incommensurate soft mode. Their matrix elements in the dynamic spin structure factor ${S}_{\mathrm{zz}}(q,\ensuremath{\omega})$ are calculated directly from the Bethe wave functions for finite N. The resulting line- shape predictions for $\stackrel{\ensuremath{\rightarrow}}{N}\ensuremath{\infty}$ complement the exact results previously derived via algebraic analysis for the exact two-spinon part of ${S}_{\mathrm{zz}}(q,\ensuremath{\omega})$ in the zero-field limit. They are relevant for neutron-scattering experiments on quasi-1D antiferromagnetic compounds in a strong magnetic field.
The exact expression derived by Bougourzi, Couture, and Kacir for the two-spinon contribution to the dynamic spin structure factor S(q,\ensuremath{\omega}) of the one-dimensional s=1/2 Heisenberg antiferromagnet at T=0 is evaluated for direct comparison with finite-chain transition rates (N\ensuremath{\leqslant}28) and an approximate analytical result previously inferred from finite-N data, sum rules, and Bethe ansatz calculations. The two-spinon excitations account for 72.89% of the total intensity in S(q,\ensuremath{\omega}). The singularity structure of the exact result is determined analytically and its spectral-weight distribution evaluated numerically over the entire range of the two-spinon continuum. The leading singularities of the frequency-dependent spin autocorrelation function, static spin structure factor, and q dependent susceptibility are determined via sum rules. The impact of the non-two-spinon excitations on the integrated intensity, the susceptibility, the frequency moments, and the Euclidian time representation of S(q,\ensuremath{\omega}) is studied on the basis of finite-size data.