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Magnetization and quantum entanglement processes in the triangularSpins -½ frustrated.

Raphael Cavalcante Alécio

Published May 26, 2017• 0 citations
OpenAlex

Abstract

This thesis is dedicated to the analytical and numerical study of quantum entanglement and nonlocality in strongly correlated quantum spin tube models in connection with various thermodynamic properties and magnetization processes. More specifically, the study builds on the analysis of the behavior of these physical quantities within a particular spinning network that includes competitive interactions and quantum fluctuations known as a three-leg spins ladder or triangular spin tube, due to the periodic boundary conditions imposed on the three spins that form the Heisenberg steps of this network. In systems with this structure described above, magnetization plateaus are formed due to the competition imposed by the geometric frustration that the network imposes on the spins and the applied external field. Such competition is the mechanism that defines the orientation of the magnetic domains that the network will present, which within specific regions of the network parameters space create regions where there is a discontinuous response of local magnetization to external field variations, such regions are known as magnetization plateaus. To evaluate the frustrated spin- ½ Ising-Heisenberg triangular tube consisting of a spin tube formed by triangular unit cells with 3 spins-½ interconnected by Heisenberg couplings between neighboring first spins and the pairs of neighboring first spins belonging to the different cells have their interaction intermediated through classical Ising couplings, an exact analytical procedure, known as a transfer-matrix technique, was used to obtain the analytical solutions for various thermodynamic properties of the model, including magnetization, specific heat and magnetization profiles. These quantities were evaluated as a function of temperature, external magnetic field and the relevant couplings. However, it was necessary to apply a different methodology to obtain thermodynamic measurements for the other model proposed in this thesis: the frustrated spin- ½ Heisenberg triangular tube, which consists of a spin tube with similar structure to the previous one, except that the pairs of the first neighboring spins belonging to the different cells interact through Heisenberg-type quantum connections. In this case, a numerical procedure known as the quantum density matrix renormalization group method, known as DMRG, is used to obtain the ground state diagrams, magnetization processes, and bipartite quantum entanglement of the Heisenberg triangular tubes as a function of the external magnetic field and the relevant couplings. In both models, the magnetization curves exhibit discontinuous magnetization jumps and intermediate plateaus due to discontinuous phase transitions induced by the external field, These transitions are also reflected in the exotic behavior of some thermodynamic quantities of the models, such as the presence of a striking low temperature peak for the specific heat curve and a highlighted magnetocaloric effect.

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This thesis is dedicated to the analytical and numerical study of quantum entanglement and nonlocality in strongly correlated quantum spin tube models in connection with various thermodynamic properties and magnetization processes. More specifically, the study builds on the analysis of the behavior of these physical quantities within a particular spinning network that includes competitive interactions and quantum fluctuations known as a three-leg spins ladder or triangular spin tube, due to the periodic boundary conditions imposed on the three spins that form the Heisenberg steps of this network. In systems with this structure described above, magnetization plateaus are formed due to the competition imposed by the geometric frustration that the network imposes on the spins and the applied external field. Such competition is the mechanism that defines the orientation of the magnetic domains that the network will present, which within specific regions of the network parameters space create regions where there is a discontinuous response of local magnetization to external field variations, such regions are known as magnetization plateaus. To evaluate the frustrated spin- ½ Ising-Heisenberg triangular tube consisting of a spin tube formed by triangular unit cells with 3 spins-½ interconnected by Heisenberg couplings between neighboring first spins and the pairs of neighboring first spins belonging to the different cells have their interaction intermediated through classical Ising couplings, an exact analytical procedure, known as a transfer-matrix technique, was used to obtain the analytical solutions for various thermodynamic properties of the model, including magnetization, specific heat and magnetization profiles. These quantities were evaluated as a function of temperature, external magnetic field and the relevant couplings. However, it was necessary to apply a different methodology to obtain thermodynamic measurements for the other model proposed in this thesis: the frustrated spin- ½ Heisenberg triangular tube, which consists of a spin tube with similar structure to the previous one, except that the pairs of the first neighboring spins belonging to the different cells interact through Heisenberg-type quantum connections. In this case, a numerical procedure known as the quantum density matrix renormalization group method, known as DMRG, is used to obtain the ground state diagrams, magnetization processes, and bipartite quantum entanglement of the Heisenberg triangular tubes as a function of the external magnetic field and the relevant couplings. In both models, the magnetization curves exhibit discontinuous magnetization jumps and intermediate plateaus due to discontinuous phase transitions induced by the external field, These transitions are also reflected in the exotic behavior of some thermodynamic quantities of the models, such as the presence of a striking low temperature peak for the specific heat curve and a highlighted magnetocaloric effect.
We use a combination of numerical density matrix renormalization group calculations and several analytical approaches to comprehensively study a simplified model for a spatially anisotropic spin-12\frac{1}{2}21​ triangular lattice Heisenberg antiferromagnet: the three-leg triangular spin tube (TST). The model is described by three Heisenberg chains, with exchange constant JJJ, coupled antiferromagnetically with exchange constant ${J}^{\ensuremath{'}}$ along the diagonals of the ladder system, with periodic boundary conditions in the shorter direction. Here, we determine the full phase diagram of this model as a function of both spatial anisotropy (between the isotropic and decoupled chain limits) and magnetic field. We find a rich phase diagram, which is remarkably dominated by quantum states: the phase corresponding to the classical ground state appears only in an exceedingly small region. Among the dominant phases generated by quantum effects are commensurate and incommensurate coplanar quasiordered states, which appear in the vicinity of the isotropic region for most fields, and in the high-field region for most anisotropies. The coplanar states, while not classical ground states, can at least be understood semiclassically. Even more strikingly, the largest region of phase space is occupied by a spin density wave phase, which has incommensurate collinear correlations along the field. This phase has no semiclassical analog, and may be ascribed to enhanced one-dimensional fluctuations due to frustration. Cutting across the phase diagram is a magnetization plateau, with a gap to all excitations and ``up-up-down'' spin order, with a quantized magnetization equal to 13\frac{1}{3}31​ of the saturation value. In the TST, this plateau extends almost but not quite to the decoupled chains limit. Most of the above features are expected to carry over to the two-dimensional system, which we also discuss. At low field, a dimerized phase appears, which is particular to the one-dimensional nature of the TST, and which can be understood from quantum Berry phase arguments.
Spins models, despite their simplicity, are known to describe with great precision physical properties of the materials. Of particular interest are the one-dimensional models that present an exact analytical solution, which can be obtained by the transfer matrix method and the decoration-iteration transformation technique. In this thesis, we studied a spin-electron model and two Ising-Heisenberg spin models, where all models are exactly soluble. The first model we investigate concerns a spin-electron diamond chain with Ising spins located on the local sites and mobile electrons dislocated in the interstitial sites under the external magnetic field action. We analyzed the ground states and the correlation between the spins. We show that thermal fluctuations can lead to the emergence of quantum entanglement above the unfrustrated ground states. We also analyze this same model but for different Landé g-factors. We investigated the phase diagrams at zero temperature. We also analyze the magnetization and we show that the magnetic field can cause the emergence of quantum entanglement in some conditions above the non-entanglement ground states. In this same context, we studied the Ising-XYZ diamond model of spin-1/2, with interaction between the second neighbours of the nodal Ising spins, and an external magnetic field applied to the z-axis. We investigate the phase diagram at zero temperature and the quantum entanglement. We notice that the bipartite entanglement between the pairs of Heisenberg interstitial spins in the natural mineral azurite is insensitive to the external magnetic field applied up to approximately 30 K. The third model we studied is a classical-quantum chain consisting of regularly alternating Ising and Heisenberg spins and with two different local anisotropy axes, subject to an applied external magnetic field. We studied the ground states, the magnetization and the susceptibility. It is evidenced that the investigated spin model reproduces magnetic characteristics of the heterobimetallic coordination compound Dy(NO)3(DMSO)2Cu(opba)(DMSO)2. In this thesis we show that the exact soluble spin models can describe with good precision a class of real magnetic materials, which can present interesting magnetic and thermodynamic properties, and quantum entanglement.
The frustrated spin-1/2 Ising-Heisenberg ladder with Heisenberg intra-rung and Ising inter-rung interactions is exactly solved in a longitudinal magnetic field by taking advantage of the local conservation of the total spin on each rung and the transfer-matrix method. We have rigorously calculated the ground-state phase diagram, magnetization process, magnetocaloric effect, and basic thermodynamic quantities for the model, which can be alternatively viewed as an Ising-Heisenberg tetrahedral chain. It is demonstrated that a stepwise magnetization curve with an intermediate plateau at half of the saturation magnetization is also reflected in respective stepwise changes of the concurrence serving as a measure of bipartite entanglement. The ground-state phase diagram and zero-temperature magnetization curves of the Ising-Heisenberg tetrahedral chain are contrasted with the analogous results of the purely quantum Heisenberg tetrahedral chain, which have been obtained through density-matrix renormalization group (DMRG) calculations. While both ground-state phase diagrams fully coincide in the regime of weak inter-rung interaction, the purely quantum Heisenberg tetrahedral chain develops Luttinger spin-liquid and Haldane phases for strongly coupled rungs, which are absent in the Ising-Heisenberg counterpart model.
We study the ground state phase diagram of the twisted three-leg spin tube in magnetic fields by the density matrix renormalization group (DMRG) method. The twisted spin tube is composed of triangular unit cells and possesses strong quantum fluctuations under geometrical frustration. We apply the sine square deformation method to remove the strong boundary effects and obtain smooth magnetization curves without steps of finite systems. With the analysis of the magnetization curves and correlation functions we determine the ground state phase diagram consisting of (a) a Tomonaga-Luttinger (TL) liquid characterized by spin-32\frac{3}{2}23​ Heisenberg model, (b) 3-sublattice state named UUD with 1/3 magnetization and (c) TL-liquid of massless chirality with 1/3 magnetization plateau, (d) TL-liquid of massless spin mode with or without chirality quasi long-range order.
Low-temperature magnetization curves and thermodynamics of a frustrated spin-12\frac{1}{2}21​ Heisenberg triangular bilayer with the antiferromagnetic intradimer interaction and either ferromagnetic or antiferromagnetic interdimer interaction are investigated in a highly frustrated parameter region, where localized many-magnon eigenstates provide the most dominant contribution to magnetothermodynamics. Low-energy states of the highly frustrated spin-12\frac{1}{2}21​ Heisenberg triangular bilayer can be accordingly found from a mapping correspondence with an effective triangular-lattice spin-12\frac{1}{2}21​ Ising model in a field. A description based on the effective Ising model implies that the frustrated Heisenberg triangular bilayer with the ferromagnetic interdimer coupling displays in a zero-temperature magnetization curve discontinuous magnetization jump, which is reduced upon increasing of temperature until a continuous field-driven phase transition from the Ising universality class is reached at a certain critical temperature. The frustrated Heisenberg triangular bilayer with the antiferromagnetic interdimer coupling contrarily exhibits multistep magnetization curve with intermediate plateaus at 13\frac{1}{3}31​ and 23\frac{2}{3}32​ of the saturation magnetization, whereas discontinuous magnetization jumps observable at zero temperature change to continuous field-driven phase transitions from the universality class of three-state Potts model at sufficiently low temperatures. Exact results and Monte Carlo simulations of the effective Ising model are confronted with full exact diagonalization data for the Heisenberg triangular bilayer in order to corroborate these findings.
We study the ground state phase diagram of a frustrated spin-1/2 four-leg tube in an external magnetic field. We explore the parameter space of this model in the regime of all-antiferromagnetic exchange couplings by means of three different approaches: density matrix renormalization group (DMRG), a low-energy effective Hamiltonian (LEH) and a Hartree variational approach (HVA). We find that in the limit of weakly interacting plaquettes, singlet and triplet states play an important role in the formation of magnetization plateaux. We study the transition regions numerically and analytically, and find that they are described, at first order in a strong- coupling expansion, by an XXZ spin-1/2 chain in a magnetic field. These results are consistent with the DMRG and HVA calculations.