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Journal of Magnetism and Magnetic Materials

Spin excitations on finite lattices and the discrete Fourier transform

S. Cojocaru, Victor Bârsan, Arnout Jozef Ceulemans

Published Apr 18, 2006• 4 citations
Publisher

Abstract

The method of discrete Fourier transform (DFT) is applied to obtain the exact one- or bi-magnonic states in several finite one-dimensional spin systems. The advantage of DFT method, compared to Bethe ansatz, is that no assumption is made on the form of the wave function and that its limit of infinite system reduces to the standard approach to excitation spectra in condensed matter. So the method has, in principle, no limitation on lattice dimensionality and its physical interpretation is relatively transparent. It is demonstrated that the two approaches (DFT and BA) give identical results for the solution of the Schrodinger equation on the 1D lattice, although the structure of the methods is rather different. The excitation spectrum of the XXZ chain with arbitrary end fields is analyzed in detail and an analogy with atomic wires is briefly discussed.

DOI
10.1016/j.jmmm.2006.03.040

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The method of discrete Fourier transform (DFT) is applied to obtain the exact one- or bi-magnonic states in several finite one-dimensional spin systems. The advantage of DFT method, compared to Bethe ansatz, is that no assumption is made on the form of the wave function and that its limit of infinite system reduces to the standard approach to excitation spectra in condensed matter. So the method has, in principle, no limitation on lattice dimensionality and its physical interpretation is relatively transparent. It is demonstrated that the two approaches (DFT and BA) give identical results for the solution of the Schrodinger equation on the 1D lattice, although the structure of the methods is rather different. The excitation spectrum of the XXZ chain with arbitrary end fields is analyzed in detail and an analogy with atomic wires is briefly discussed.
Abstract New analytical results are obtained for the Green's function of a finite one‐dimensional lattice with nearest neighbor interaction using discrete Fourier transform. The method offers an alternative to the Bethe Ansatz, but does not require any a priori assumption on the form of the wavefunction. This makes it suitable for extensions to nano‐ferromagnets of higher dimensions. Solutions of the Heisenberg spin chain with periodic and open boundary conditions are considered as examples. (© 2006 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim)
Unlike the Fourier series expansion, the discrete Fourier transform is defined on a finite basis set of harmonic functions. The first approach is widely used in condensed matter to describe the thermodynamic limit of various lattice models, while the latter did not receive sufficient development that would allow to address finite lattices. In the present paper a general expression for the Green's function of a finite one-dimensional lattice with nearest neighbor interaction is derived for the first time via discrete Fourier transform. Solution of the Heisenberg spin chain with periodic and open boundary conditions is considered as an example. Although the final expressions are completely equivalent to Bethe ansatz, the examples allow us to clarify the differences between the two approaches. On the other hand, it is explained why the well known results obtained by Fourier series expansion were incomplete and thus provides a deeper understanding of the approach.
We systematically investigate the mode dispersion and spectral weight of the elementary excitation spectra in one-dimensional continuum and lattice electron systems by using the RPA, the Luttinger liquid model, and the Hubbard model. Both charge and spin excitations are studied in detail and compared among the theoretical models. For the lattice Hubbard model we use both Bethe-ansatz equations and Lanczos-Gagliano method to calculate dispersion and spectral weight separately. We discuss the theoretically calculated elementary excitation spectra in terms of the experimental inelastic light (Raman) scattering spectroscopy of one-dimensional (1D) semiconductor quantum wire systems. Our results show that in the polarized (i.e., non-spin-flip) Raman-scattering spectroscopy, only the 1D charge density excitations should show up with observable spectral weight with the single-particle excitations (in random-phase approximation) or singlet spin excitations (in the Luttinger model and the Hubbard model) having negligible spectral weight. The depolarized (spin-flip) Raman-scattering spectra manifest the spin density or the triplet spin excitations. We also provide a qualitative comparison between the continuum and the lattice 1D elementary excitation spectra.
In this paper we propose an efficient routine to carry out finite size scaling studies of one-dimensional massive lattice models. Unlike massless systems, for which the lattice and continuum models yield the same results for low-lying excitations due to the infinite correlation length, the massive continuum models can at best approximate their lattice counterparts because of the intrinsic length scale $\ensuremath{\xi}\ensuremath{\sim}{\ensuremath{\Delta}}^{\ensuremath{-}1},$ where $\ensuremath{\Delta}$ is the mass gap. On examples of antiferromagnetic gapped spin-1/2 XXZ\mathrm{XXZ}XXZ chains we show explicitly that several relations between physical quantities like the mass gap, spin-wave velocity v,v,v, and the correlation length \ensuremath{\xi}, derived from the continuum models deviate significantly from the numerical results obtained for finite chains, when $\ensuremath{\xi}$ is comparable with the lattice spacing a0.{a}_{0}.a0​. On the other hand, we find if the dispersion for elementary excitations is modified from the ``Lorentz invariant'' form $\sqrt{{\ensuremath{\Delta}}^{2}{+v}^{2}{p}^{2}}$ to $\sqrt{{\ensuremath{\Delta}}^{2}{+v}^{2}{\mathrm{sin}}^{2}p},$ the spin-wave velocity vvv becomes almost size independent, and the appropriately defined correlation length using that dispersion agrees very well with numerical results. In fact, this follows from the Bethe ansatz solution for the spin-1/2 XXZ\mathrm{XXZ}XXZ chains. Based on our previous experience and these considerations we propose scaling equations to obtain the ground-state energy, mass gap, correlation length, spin-wave velocity, and scattering length between the massive elementary excitations. Only three low energy levels are needed in this method. Although the method is illustrated on the gapped XXZ\mathrm{XXZ}XXZ quantum spins, it is applicable to all one-dimensional lattice models with massive relativistic low energy dispersions. To substantiate our statement we show explicitly that the numerical data for the Ising model in a transverse magnetic field fully agree with the finite-size scaling based on the correlation length newly defined from the exact analytic solution.
In this work, we introduce a definition of the Discrete Fourier Transform (DFT) on Euclidean lattices in Rn\R^nRn, that generalizes the nnn-th fold DFT of the integer lattice Zn\Z^nZn to arbitrary lattices. This definition is not applicable for every lattice, but can be defined on lattices known as Systematic Normal Form (SysNF) introduced in \cite{ES16}. Systematic Normal Form lattices are sets of integer vectors that satisfy a single homogeneous modular equation, which itself satisfies a certain number-theoretic property. Such lattices form a dense set in the space of nnn-dimensional lattices, and can be used to approximate efficiently any lattice. This implies that for every lattice LLL a DFT can be computed efficiently on a lattice near LLL. Our proof of the statement above uses arguments from quantum computing, and as an application of our definition we show a quantum algorithm for sampling from discrete distributions on lattices, that extends our ability to sample efficiently from the discrete Gaussian distribution \cite{GPV08} to any distribution that is sufficiently "smooth". We conjecture that studying the eigenvectors of the newly-defined lattice DFT may provide new insights into the structure of lattices, especially regarding hard computational problems, like the shortest vector problem.