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arXiv:cond-mat/0505573 · Physical Review B

Valence-bond-solid order in antiferromagnets with spin-lattice coupling

Chenglong Jia, Jung Hoon Han

Published May 18, 2006• 3 citations
arXivHTMLPDF

Abstract

We propose that a valence-bond-solid (VBS) order can be stabilized in certain two-dimensional antiferromagnets due to spin-lattice coupling. In contrast to the VBS state of the Affleck-Kennedy-Lieb-Tasaki (AKLT) type, the spin-lattice coupling-induced VBS state can occur when $2S$ is not an integer multiple of the coordination number $z$. $S=2$ spins on the triangular lattice with $z=6$ is discussed as an example. Within the Schwinger boson mean-field theory the ground state is derived as the direct product of states, one of which represents the conventional long-range ordered spins, and the other given by the $\sqrt{3}\ifmmode\times\else\texttimes\fi{}\sqrt{3}$ modulation of the valence bond amplitudes. Excitation spectrum for the modulated valence bond state is worked out within the single-mode approximation. The spectrum offers a new collective mode, distinct from the spin wave excitations of the magnetically ordered ground state, and observable in neutron scattering.

DOI
10.1103/physrevb.73.172411

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Affleck, Kennedy, Lieb, and Taski (AKLT) constructed an exemplary spin-3/2 valence-bond solid (VBS) state on the hexagonal lattice, which is the ground state of an isotropic quantum antiferromagnet and possesses no spontaneous magnetization but finite correlation length. This is distinct from the N\'eel ordered state of the spin-3/2 Heisenberg model on the same lattice. Niggemann, Kl\"umper, and Zittartz then generalized the AKLT Hamiltonian to one family invariant under spin rotation about the $z$ axis. The ground states of this family can be parameterized by a single parameter that deforms the AKLT state, and this system exhibits a quantum phase transition between the VBS and N\'eel phases, as the parameter increases from the AKLT point to large anisotropy. We investigate the opposite regime when the parameter decreases from the AKLT point and find that there appears to be a Berezinskii-Kosterlitz-Thouless-like transition from the VBS phase to an XY phase. Such a transition also occurs in the deformation of other types of AKLT states with triplet-bond constructions on the same lattice. However, we do not find such an XY-like phase in the deformed AKLT models on other trivalent lattices, such as square-octagon, cross, and star lattices. On the star lattice, the deformed family of AKLT states remain in the same phase as the isotropic AKLT state throughout the whole region of the parameter. However, for two triplet-bond generalizations, the triplet VBS phase is sandwiched between two ferromagnetic phases (for large and small deformation parameters, respectively), which are characterized by spontaneous magnetizations along different axes. Along the way, we also discuss how various deformed AKLT states can be used for the purpose of universal quantum computation.

arXiv:1605.08417•Physical review. B./Physical review. B•Oct 14, 2016•14 citations
We propose that a valence-bond-solid (VBS) order can be stabilized in certain two-dimensional antiferromagnets due to spin-lattice coupling. In contrast to the VBS state of the Affleck-Kennedy-Lieb-Tasaki (AKLT) type, the spin-lattice coupling-induced VBS state can occur when 2S2S2S is not an integer multiple of the coordination number zzz. S=2S=2S=2 spins on the triangular lattice with z=6z=6z=6 is discussed as an example. Within the Schwinger boson mean-field theory the ground state is derived as the direct product of states, one of which represents the conventional long-range ordered spins, and the other given by the 3\ifmmode×\else\texttimes\fi3\sqrt{3}\ifmmode\times\else\texttimes\fi{}\sqrt{3}3​\ifmmode×\else\texttimes\fi3​ modulation of the valence bond amplitudes. Excitation spectrum for the modulated valence bond state is worked out within the single-mode approximation. The spectrum offers a new collective mode, distinct from the spin wave excitations of the magnetically ordered ground state, and observable in neutron scattering.
Recent scanning tunneling microscopy (STM) experiments on underdoped cuprates have displayed modulations in the local electronic density of states, which are centered on a Cu-O-Cu bond [Kohsaka et al., Science 315, 1380 (2007)]. As a paradigm of the pinning of such bond-centered ordering in strongly correlated systems, we present the theory of valence bond solid (VBS) correlations near a single impurity in a square lattice antiferromagnet. The antiferromagnet is assumed to be in the vicinity of a quantum transition from a magnetically ordered N\'eel state to a spin-gap state with long-range VBS order. We identify two distinct classes of impurities: (i) local modulation in the exchange constants and (ii) a missing or additional spin, for which the impurity perturbation is represented by an uncompensated Berry phase. The ``boundary'' critical theory for these classes is developed. In the second class, we find a VBS pinwheel around the impurity, accompanied by a suppression in the VBS susceptibility. Implications for numerical studies of quantum antiferromagnets and for STM experiments on the cuprates are noted.
Abstract. We study the structure of quantum ground states of simplex solid models, which are generalizations of the valence bond construction for quantum antiferromagnets originally proposed by Affleck, Kennedy, Lieb, and Tasaki (AKLT) (1987 Phys. Rev. Lett . 59 799). Whereas the AKLT states are created by application of bond singlet operators for spins, the simplex solid construction is based on N -simplex singlet operators for spins. In both cases, a discrete one-parameter family of translationally-invariant models with exactly solvable ground states is defined on any regular lattice, and the equal time ground state correlations are given by the finite temperature correlations of an associated classical model on the same lattice, owing to the product form of the wave functions when expressed in a coherent state representation. We study these classical companion models via a mix of Monte Carlo simulations, mean-field arguments, and low-temperature effective field theories. Our analysis reveals that the ground states of edge- and face-sharing cubic lattice simplex solid models are long range ordered for sufficiently large values of the discrete parameter, whereas the ground states of the models on the kagome (2D) and hyperkagome (3D) lattices are always quantum disordered. The kagome simplex solid exhibits strong local order absent in its three-dimensional hyperkagome counterpart, a contrast that we rationalize with arguments similar to those leading to ‘order by disorder’.
I define a set of wave functions for SU(N)\mathrm{SU}(N)SU(N) lattice antiferromagnets, analogous to the valence bond solid states of Affleck et al. [Phys. Rev. Lett. 59, 799 (1987); Commun. Math. Phys. 115, 477 (1988)], in which the singlets are extended over NNN-site simplixes. As with the valence bond solids, the new simplex solid (SS) states are extinguished by certain local projection operators, allowing one to construct Hamiltonians with local interactions which render the SS states exact ground states. Using a coherent state representation, I show that the quantum correlations in each SS state are calculable as the finite temperature correlations of an associated classical model with NNN-spin interactions on the same lattice. In three and higher dimensions, the SS states can spontaneously break SU(N)\mathrm{SU}(N)SU(N) and exhibit NNN-sublattice long-ranged order as a function of a discrete parameter which fixes the local representation of SU(N)\mathrm{SU}(N)SU(N). I analyze this transition using a classical mean field approach. For N>2N>2N>2, the ordered state is selected via an ``order by disorder'' mechanism. As in the Affleck-Kennedy-Lieb-Tasaki case, the bulk representations fractionalize at an edge, and the ground state entropy is proportional to the volume of the boundary.
The spin-1/2 quantum antiferromagnet on the kagome lattice provides a quintessential example in strongly correlated electron physics in which the effects of both geometric frustration and quantum fluctuation are pushed to their limit. Among possible nonmagnetic ground states, the valence bond solid (VBS) with a 36-site unit cell is one of the most promising candidates. A natural theoretical framework for the analysis of such VBS order is to consider quantum states on a bond connecting the nearest-neighboring sites as fundamental quantum modes of the system and treat them as effectively independent ``bond particles.'' While correctly describing the VBS order in the ground state, this approach, known as the bond operator theory, significantly overestimates the lowest spin excitation energy. To overcome this problem, we take a next logical step in this paper to improve the bond operator theory and consider extended spin clusters as fundamental building blocks of the system. Depending on two possible configurations of the VBS order, various spin clusters are considered: (i) in the VBS order with staggered hexagonal resonance, we consider one spin cluster for a star of David shape and two spin clusters with each composed of a perfect hexagon and three attached dimers, and (ii) in the VBS order with uniform hexagonal resonance, we consider one spin cluster composed of a star of David and three attached dimers. It is shown that the majority of low-energy spin excitations are nearly or perfectly flat in energy. With most of its weight coming from the star of David, the lowest spin excitation has a gap much lower than the previous value obtained by the bond operator theory, narrowing the difference against exact diagonalization results. Despite the better agreement, however, the fact that the lowest spin excitation mostly comes from the star-of-David structure is at odds with the bond operator theory as well as previous series expansion studies. Expecting that the true low-energy spin excitations have contributions from both the star of David and its surroundings, we propose using two superclusters of spin in future work, treating spin excitations from both contributions on a more equal footing.
The qualitative difference in low-energy properties of spin S quantum antiferromagnetic chains with integer S and half-odd-integer S discovered by Haldane [F. D. M. Haldane, arXiv:1612.00076 (1981); Phys. Lett. A 93, 464–468 (1983); Phys. Rev. Lett. 50, 1153–1156 (1983)] and Tasaki [Tasaki, Graduate Texts in Physics (Springer, 2020)] can be intuitively understood in terms of the valence-bond picture proposed by Affleck et al. [I. Affleck, Phys. Rev. Lett. 59, 799 (1987); Commun. Math. Phys. 115, 477–528 (1988)]. Here, we develop a similarly intuitive diagrammatic explanation of the qualitative difference between chains with odd S and even S, which is at the heart of the theory of symmetry-protected topological (SPT) phases. (There is a 24 min video in which the essence of the present work is discussed: https://youtu.be/URsf9e_PLlc.) More precisely, we define one-parameter families of states, which we call the asymmetric valence-bond solid (VBS) states, that continuously interpolate between the Affleck–Kennedy–Lieb–Tasaki (AKLT) state and the trivial zero state in quantum spin chains with S = 1 and 2. The asymmetric VBS state is obtained by systematically modifying the AKLT state. It always has exponentially decaying truncated correlation functions and is a unique gapped ground state of a short-ranged Hamiltonian. We also observe that the asymmetric VBS state possesses the time-reversal, the Z2×Z2, and the bond-centered inversion symmetries for S = 2 but not for S = 1. This is consistent with the known fact that the AKLT model belongs to the trivial SPT phase if S = 2 and to a nontrivial SPT phase if S = 1. Although such interpolating families of disordered states were already known, our construction is unified and is based on a simple physical picture. It also extends to spin chains with general integer S and provides us with an intuitive explanation of the essential difference between models with odd and even spins.
Affleck, Kennedy, Lieb, and Taski (AKLT) constructed an exemplary spin-3/2 valence-bond solid (VBS) state on the hexagonal lattice, which is the ground state of an isotropic quantum antiferromagnet and possesses no spontaneous magnetization but finite correlation length. This is distinct from the N\'eel ordered state of the spin-3/2 Heisenberg model on the same lattice. Niggemann, Kl\"umper, and Zittartz then generalized the AKLT Hamiltonian to one family invariant under spin rotation about the zzz axis. The ground states of this family can be parameterized by a single parameter that deforms the AKLT state, and this system exhibits a quantum phase transition between the VBS and N\'eel phases, as the parameter increases from the AKLT point to large anisotropy. We investigate the opposite regime when the parameter decreases from the AKLT point and find that there appears to be a Berezinskii-Kosterlitz-Thouless-like transition from the VBS phase to an XY phase. Such a transition also occurs in the deformation of other types of AKLT states with triplet-bond constructions on the same lattice. However, we do not find such an XY-like phase in the deformed AKLT models on other trivalent lattices, such as square-octagon, cross, and star lattices. On the star lattice, the deformed family of AKLT states remain in the same phase as the isotropic AKLT state throughout the whole region of the parameter. However, for two triplet-bond generalizations, the triplet VBS phase is sandwiched between two ferromagnetic phases (for large and small deformation parameters, respectively), which are characterized by spontaneous magnetizations along different axes. Along the way, we also discuss how various deformed AKLT states can be used for the purpose of universal quantum computation.