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arXiv:0912.5213 · New Journal of Physics

Modified spin-wave theory with ordering vector optimization: frustrated bosons on the spatially anisotropic triangular lattice

Philipp Hauke, Tommaso Roscilde, V. Murg, J. I. Cirac, Roman Schmied

Published May 21, 2010• 32 citations
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Abstract

We investigate a system of frustrated hardcore bosons, modeled by an XY antiferromagnet on the spatially anisotropic triangular lattice, using Takahashi's modified spin-wave (MSW) theory. In particular, we implement ordering vector optimization on the ordered reference state of MSW theory, which leads to significant improvement of the theory and accounts for quantum corrections to the classically ordered state. The MSW results at zero temperature compare favorably to exact diagonalization (ED) and projected entangled-pair state (PEPS) calculations. The resulting zero-temperature phase diagram includes a one-dimensional (1D) quasi-ordered phase, a 2D Néel ordered phase and a 2D spiraling ordered phase. Strong indications coming from the ED and PEPS calculations, as well as from the breakdown of MSW theory, suggest that the various ordered or quasi-ordered phases are separated by spin-liquid phases with short-range correlations, in analogy to what has been predicted for the Heisenberg model on the same lattice. Within MSW theory, we also explore the finite-temperature phase diagram. In agreement with the Berezinskii–Kosterlitz–Thouless (BKT) theory, we find that zero-temperature long-range-ordered phases turn into quasi-ordered phases (up to a BKT transition temperature), while zero-temperature quasi-ordered phases become short-range correlated at finite temperature. These results show that, despite its simplicity, MSW theory is very well suited to describing ordered and quasi-ordered phases of frustrated XY spins (or, equivalently, of frustrated lattice bosons) both at zero and finite temperatures. While MSW theory, just as other theoretical methods, cannot describe spin-liquid phases, its breakdown provides a fast and reliable method for singling out Hamiltonians that may feature these intriguing quantum phases. We thus suggest a tool for guiding our search for interesting systems whose properties are necessarily studied with a physical quantum simulator instead of theoretical methods.

DOI
10.1088/1367-2630/12/5/053036

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Modified spin-wave theory with ordering vector optimization: spatially anisotropic triangular lattice andJ1J2J3model with Heisenberg interactions

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Spin wave theory of spin-1/2 XY model with ring exchange on a triangular lattice

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Phase diagrams of two-dimensional frustrated spin systems

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Frustrated spin systems, an MPS approach

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In spin lattices, frustration happens when there exists a competition between different terms of the Hamiltonian, which cannot be simultaneously minimized in all local physical bases. Frustration can destabilize the bipartite Neel order, which is the conventional groundstate of antiferromagnetic Heisenberg-type models in two dimensions. Hence, the focus of two-dimensional quantum magnetism studies has been directed toward elucidating the zero-temperature properties of Heisenberg-type models on the Archimedean lattices that exhibit geometrical frustration. This type of frustration is of great interest since it can lead to exotic forms of the quantum matter, such as topological spin-liquid (SL) and many-sublattice long-range-ordered phases. The spin-1/2 triangular Heisenberg model (THM) is a prototypical model with geometrical frustration, which has the highest coordination number of all Archimedean lattices. However, there exist two major, distinct difficulties for numerical methods to efficiently determine the groundstate properties of the THM: the immense dimension of the Hilbert space and the geometrical frustration phenomenon. In this thesis, to deal with such difficulties, we employ the state-of-the- art non-Abelian matrix product states (MPS) and density matrix renormalization group (DMRG) methods. We exploit the symmetries of the Hamiltonian to reduce the working dimension of the Hilbert space and, to lessen the effects of the geometrical frustration, we depend on the local entanglement (area-law) nature of the MPS as it scales with the size of a lattice subspace with reduced spatial dimensions. In such a way, we thoroughly examine the phase diagram of the THM with nearest and next-nearest neighbor (NN and NNN) exchange couplings on finite- and infinite-length cylinders of widths up to 12 sites. In addition, we develop new numerical tools to analyze topological and symmetry-broken phases in the context of the SU(2)-symmetric translation-invariant MPS algorithm. We establish that on infinite cylinders, the anyonic sectors of a topological order can be classified through the fractionalization of global symmetries and degeneracy patterns of the entanglement spectrum (ES). On the other hand, we detect symmetry-breaking phase transitions by a combination of the correlation lengths and second and fourth cumulants of the magnetic order parameters, even though symmetry implies that the order parameter itself is strictly zero. Furthermore, the appearance of Nambu-Goldstone modes in the excitation spectrum can be detected using “tower of states” (TOS) levels in the momentum-resolved ES. By applying the new tools to the THM, we discover a variety of exotic groundstates such as a Z2-gauge toric-code-type topological order (with vison and spinon excitations), a NNN Majumdar-Gosh, and a long-range 120◦-ordered state.

•Jun 28, 2017•2 citations
We investigate a system of frustrated hardcore bosons, modeled by an XY antiferromagnet on the spatially anisotropic triangular lattice, using Takahashi's modified spin-wave (MSW) theory. In particular, we implement ordering vector optimization on the ordered reference state of MSW theory, which leads to significant improvement of the theory and accounts for quantum corrections to the classically ordered state. The MSW results at zero temperature compare favorably to exact diagonalization (ED) and projected entangled-pair state (PEPS) calculations. The resulting zero-temperature phase diagram includes a one-dimensional (1D) quasi-ordered phase, a 2D Néel ordered phase and a 2D spiraling ordered phase. Strong indications coming from the ED and PEPS calculations, as well as from the breakdown of MSW theory, suggest that the various ordered or quasi-ordered phases are separated by spin-liquid phases with short-range correlations, in analogy to what has been predicted for the Heisenberg model on the same lattice. Within MSW theory, we also explore the finite-temperature phase diagram. In agreement with the Berezinskii–Kosterlitz–Thouless (BKT) theory, we find that zero-temperature long-range-ordered phases turn into quasi-ordered phases (up to a BKT transition temperature), while zero-temperature quasi-ordered phases become short-range correlated at finite temperature. These results show that, despite its simplicity, MSW theory is very well suited to describing ordered and quasi-ordered phases of frustrated XY spins (or, equivalently, of frustrated lattice bosons) both at zero and finite temperatures. While MSW theory, just as other theoretical methods, cannot describe spin-liquid phases, its breakdown provides a fast and reliable method for singling out Hamiltonians that may feature these intriguing quantum phases. We thus suggest a tool for guiding our search for interesting systems whose properties are necessarily studied with a physical quantum simulator instead of theoretical methods.
We study the ground-state phases of the S =1/2 Heisenberg quantum antiferromagnet on the spatially anisotropic triangular lattice (SATL) and on the square lattice with up to next-next-nearest-neighbor coupling (the J 1 J 2 J 3 model), making use of Takahashi's modified spin-wave (MSW) theory supplemented by ordering vector optimization. We compare the MSW results with exact diagonalization and projected-entangled-pair-states calculations, demonstrating their qualitative and quantitative reliability. We find that the MSW theory correctly accounts for strong quantum effects on the ordering vector of the magnetic phases of the models under investigation: in particular, collinear magnetic order is promoted at the expense of non-collinear (spiral) order, and several spiral states that are stable at the classical level disappear from the quantum phase diagram. Moreover, collinear states and non-collinear ones are never connected continuously, but they are separated by parameter regions in which the MSW theory breaks down, signaling the possible appearance of a non-magnetic ground state. In the case of the SATL, a large breakdown region appears also for weak couplings between the chains composing the lattice, suggesting the possible occurrence of a large non-magnetic region continuously connected with the spin-liquid state of the uncoupled chains. This shows that the MSW theory is—despite its apparent simplicity—a versatile tool for finding candidate regions in the case of spin-liquid phases, which are among prime targets for relevant quantum simulations.
Spin liquids are important for a fundamental understanding of quantum magnetism and may find applications in quantum computing, but it is still not clear under which general circumstances these exotic, quantum-disordered phases occur. To gather deeper insights, we analyze a generalization of the spatially anisotropic triangular lattice (SATL), the spatially completely anisotropic triangular lattice (SCATL), using Takahashi's modified spin-wave theory, complemented by exact diagonalizations. For Heisenberg interactions, calculations on the SATL predict quantum disorder for several materials in which experiments have found magnetic long-range order. In the SCATL, the corresponding parameter values yield ordered ground states and this discrepancy disappears. We also study the model with XYXYXY interactions, which can be implemented with current technology in ultracold atoms in optical lattices. This allows to estimate the stability of quantum-disordered phases towards imperfect implementations of the coupling parameters. For both kinds of interactions, we find indications for extended quantum-disordered phases. In part of the parameter space of the XYXYXY model, exact diagonalization hints at a gapped state with chiral long-range order. In both models, our results suggest that two gapped nonmagnetic regions, identified as distinct in the SATL, could actually be continuously connected via the additional anisotropy of the SCATL. Further, we find that different kinds of order are always separated by disordered phases. We propose that this is a quite universal feature of two-dimensional frustrated antiferromagnets with continuous symmetry in the couplings. The SCATL may therefore---besides being relevant for experiments---yield fundamental insight into quantum-disordered phases.
Simulating strongly correlated systems with incommensurate order poses significant challenges for traditional finite-size-based approaches. Confining such a phase to a finite-size geometry can induce spurious frustration, with spin spirals in frustrated magnets being a typical example. Here, we introduce an Ansatz based on infinite projected entangled-pair states which overcomes these limitations and enables the direct search for the optimal spiral in the thermodynamic limit, with a computational cost that is independent of the spiral's wavelength. Leveraging this method, we simulate the Heisenberg model on the anisotropic triangular lattice, which interpolates between the square and isotropic triangular lattice limits. Besides accurately reproducing the magnetically ordered phases with arbitrary wavelength, the simulations reveal a quantum spin liquid phase emerging between the Néel and spin spiral phases.
We present the linear spin wave theory calculation of the superfluid phase of a hard-core boson J-K model with nearest neighbour exchange J and four-particle ring-exchange K at half filling on the triangular lattice, as well as the phase diagrams of the system at zero and finite temperatures. A similar analysis has been done on a square lattice (Schaffer et al. Phys. Rev. B, 80, 014503 (2009)). We find similar behaviour to that of a square lattice but with different spin wave values of the thermodynamic quantities. We also find that the pure J model (XY model), which has a well-known uniform superfluid phase with an ordered parameter [Formula: see text] at zero temperature is quickly destroyed by the inclusion of negative-K ring-exchange interactions, favouring a state with a (4π/3, 0) ordering wavevector. We further study the behaviour of the finite-temperature Kosterlitz–Thouless phase transition (TKT) in the uniform superfluid phase, by forcing the universal quantum jump condition on the finite-temperature spin wave superfluid density. We find that for K < 0, the phase boundary monotonically decreases to T = 0 at K/J = −4/3, where a phase transition is expected and TKT decreases rapidly, while for positive K, TKT reaches a maximum at some K ≠ 0. It has been shown on a square lattice using quantum Monte Carlo (QMC) simulations that for small K > 0 away from the XY point, the zero-temperature spin stiffness value of the XY model is decreased (Melko and Sandvik. Ann. Phys. 321, 1651 (2006)). Our result seems to agree with this trend found in QMC simulations for two-dimensional systems.
In this work the ordering processes in classical frustrated Ising models and the ground-state behavior of frustrated quantum spin models are investigated. In the first part the phase transition from a high-temperature paramagnetic phase to a antiferromagnetic ground state is analyzed for the square-lattice Ising model with competing antiferromagnetic interactions between nearest- and next-nearest-neighbor spins. In the case of spatially isotropic interactions the phase transition to a collinear state is of special interest. Using Monte-Carlo simulations on finite lattices as well as field-theoretical methods for the continuous model it is shown that depending on the frustration three different sectors can be distinguished that show (i) Ising-universal behavior (ii) Ashkin-Teller-like non-universal behavior (varying critical exponents) and (iii) non-critical first-order behavior. For spatially anisotropic interactions the emergence of an intermediate incommensurate phase is verified by means of Monte-Carlo simulations which has been predicted by earlier mean-field calculations. The nature of this phase is studied analyzing spin-spin correlation functions and its ordering wave-vector reveals a strong temperature and size dependence. In the second part the influence of quantum fluctuations on classical antiferromagnetic ground states are investigated in anisotropic quantum spin-1/2 Heisenberg models with competing interactions. Using quantum Monte-Carlo simulations, exact diagonalization and perturbation theory the ground-state phase diagrams are calculated for a square lattice with nearest- and next-nearest-neighbor interactions and a honeycomb lattice with up to third-nearest-neighbor interactions whereby the fluctuations are chosen to be non-frustrating. For both cases the stability regions of classical magnetic states are identified and an intermediate phase is detected that shows no sign of long-range magnetic order. Further calculations also rule out valence-bond-crystal or topological order for this state, thus a quantum disordered ground state is stabilized in these models.
In spin lattices, frustration happens when there exists a competition between different terms of the Hamiltonian, which cannot be simultaneously minimized in all local physical bases. Frustration can destabilize the bipartite Neel order, which is the conventional groundstate of antiferromagnetic Heisenberg-type models in two dimensions. Hence, the focus of two-dimensional quantum magnetism studies has been directed toward elucidating the zero-temperature properties of Heisenberg-type models on the Archimedean lattices that exhibit geometrical frustration. This type of frustration is of great interest since it can lead to exotic forms of the quantum matter, such as topological spin-liquid (SL) and many-sublattice long-range-ordered phases. The spin-1/2 triangular Heisenberg model (THM) is a prototypical model with geometrical frustration, which has the highest coordination number of all Archimedean lattices. However, there exist two major, distinct difficulties for numerical methods to efficiently determine the groundstate properties of the THM: the immense dimension of the Hilbert space and the geometrical frustration phenomenon. In this thesis, to deal with such difficulties, we employ the state-of-the- art non-Abelian matrix product states (MPS) and density matrix renormalization group (DMRG) methods. We exploit the symmetries of the Hamiltonian to reduce the working dimension of the Hilbert space and, to lessen the effects of the geometrical frustration, we depend on the local entanglement (area-law) nature of the MPS as it scales with the size of a lattice subspace with reduced spatial dimensions. In such a way, we thoroughly examine the phase diagram of the THM with nearest and next-nearest neighbor (NN and NNN) exchange couplings on finite- and infinite-length cylinders of widths up to 12 sites. In addition, we develop new numerical tools to analyze topological and symmetry-broken phases in the context of the SU(2)-symmetric translation-invariant MPS algorithm. We establish that on infinite cylinders, the anyonic sectors of a topological order can be classified through the fractionalization of global symmetries and degeneracy patterns of the entanglement spectrum (ES). On the other hand, we detect symmetry-breaking phase transitions by a combination of the correlation lengths and second and fourth cumulants of the magnetic order parameters, even though symmetry implies that the order parameter itself is strictly zero. Furthermore, the appearance of Nambu-Goldstone modes in the excitation spectrum can be detected using “tower of states” (TOS) levels in the momentum-resolved ES. By applying the new tools to the THM, we discover a variety of exotic groundstates such as a Z2-gauge toric-code-type topological order (with vison and spinon excitations), a NNN Majumdar-Gosh, and a long-range 120◦-ordered state.