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arXiv:1503.07045 · Physical Review B

Efficient evaluation of high-order moments and cumulants in tensor network states

Colin G. West, Artur García-Sáez, Tzu-Chieh Wei

Published Sep 1, 2015• 17 citations
arXivHTMLPDF

Abstract

We present a numerical scheme for efficiently extracting the higher-order moments and cumulants of various operators on spin systems represented as tensor product states, for both finite and infinite systems, and present several applications for such quantities. For example, the second cumulant of the energy of a state, $\ensuremath{\langle}\mathrm{\ensuremath{\Delta}}{H}^{2}\ensuremath{\rangle}$, gives a straightforward method to check the convergence of numerical ground-state approximation algorithms. Additionally, we discuss the use of moments and cumulants in the study of phase transitions. Of particular interest is the application of our method to calculate the so-called Binder cumulant, which we use to detect critical points and study the critical exponent of the correlation length with only small finite numerical calculations. We apply these methods to study the behavior of a family of one-dimensional models (the transverse Ising model, the spin-1 Ising model, and the spin-1 Ising model in a crystal field), as well as the two-dimensional Ising model on a square lattice. Our results show that in one dimension, cumulant-based methods can produce precise estimates of the critical points at a low computational cost. The method shows promise for two-dimensional systems as well.

DOI
10.1103/physrevb.92.115103

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We present a numerical scheme for efficiently extracting the higher-order moments and cumulants of various operators on spin systems represented as tensor product states, for both finite and infinite systems, and present several applications for such quantities. For example, the second cumulant of the energy of a state, \ensuremath⟨\ensuremathΔH2\ensuremath⟩\ensuremath{\langle}\mathrm{\ensuremath{\Delta}}{H}^{2}\ensuremath{\rangle}\ensuremath⟨\ensuremathΔH2\ensuremath⟩, gives a straightforward method to check the convergence of numerical ground-state approximation algorithms. Additionally, we discuss the use of moments and cumulants in the study of phase transitions. Of particular interest is the application of our method to calculate the so-called Binder cumulant, which we use to detect critical points and study the critical exponent of the correlation length with only small finite numerical calculations. We apply these methods to study the behavior of a family of one-dimensional models (the transverse Ising model, the spin-1 Ising model, and the spin-1 Ising model in a crystal field), as well as the two-dimensional Ising model on a square lattice. Our results show that in one dimension, cumulant-based methods can produce precise estimates of the critical points at a low computational cost. The method shows promise for two-dimensional systems as well.
The order parameter cumulants of infinite matrix product ground states are evaluated across a quantum phase transition. A scheme using the Binder cumulant, finite-entanglement scaling, and scaling functions to obtain the critical point and exponents of the correlation length and cumulants is presented. Analogous to the scaling relations that relate the exponents of various thermodynamic quantities, a cumulant exponent relation is derived and used to check the consistency and relationship between the cumulant exponents. This scheme gives a numerically economical way of accurately obtaining the critical exponents. Examples of this scheme are shown for four one-dimensional models---the transverse field Ising model, the topological Kondo insulator, the S=1S=1S=1 Heisenberg chain with single-ion anisotropy and the Bose-Hubbard model. A two-dimensional model is also exemplified in the square lattice transverse field Ising model on an infinite cylinder. These exemplary systems portray a variety of local and string order parameters as well as phase transition classes that can be studied with the scaling functions and infinite matrix product states.
The classical simulation of many-body quantum systems is an essential tool in understanding many fundamental aspects of condensed matter physics. But a major obstacle arises from the number of degrees of freedom involved in describing such systems, which is exponential in the system size. Recently, however, a class of numerical techniques based on structures called "tensor networks" has emerged, which allows many "typical" quantum states (such as the ground states of gapped, local Hamiltonians) to be represented much more efficiently. In this work we extend and apply these techniques to consider several central topics in quantum many-body physics. After reviewing the relevant background material from the field of tensor networks and tensor network states, we demonstrate a method for computing high order moments and cumulants of operators with respect to such states, including the so-called "Binder cumulant," a powerful tool for detecting phase transitions. Next, we employ tensor network algorithms to characterize the ground state phase diagram of a quantum spin model, including both symmetry-breaking phases and symmetry protected topological order, and find a signicant variety of phases and phase transitions. Finally, we consider the entanglement properties of quantum states exhibiting many-body localization, using a combination of exact diagonalization and tensor network techniques. | 231 pages
We propose a multi-impurity method for the bond-weighted tensor renormalization group (BWTRG) to compute the higher-order moment of physical quantities in a two-dimensional system. The replacement of the bond weight with an impurity matrix in a bond-weighted triad tensor network represents a physical quantity such as the magnetization and the energy. We demonstrate that the accuracy of the proposed method is much higher than the conventional tensor renormalization group for the Ising model and the five-state Potts model. Furthermore, we perform the finite-size scaling analysis and observe that the dimensionless quantity characterizing the structure of the fixed point tensor satisfies the same scaling relation in the critical region as the Binder parameter. The estimated critical temperature dependence on the bond dimension indicates that the exponent relating the correlation length to the bond dimension varies continuously with respect to the BWTRG hyperparameter. We find that BWTRG with the optimal hyperparameter is more efficient in terms of computational time than alternative approaches based on the matrix product state in estimating the critical temperature.
Tensor networks are a class of methods for studying many-body systems. They give a geometrical description of the internal structure of many-body states, operators, and partition functions, that can be used to implement efficient algorithms to simulate them numerically. In this thesis, after providing a very brief overview of the field, we present new tensor network methods for three different use cases. \n \nFirst, we present a new real-space renormalization group algorithm for tensor networks. Compared to existing methods, its advantages are its low computational cost, simplicity of implementation, and applicability to any network. We benchmark it on the 2D classical Ising model and find accuracy comparable with the best existing tensor network methods. Due to its simplicity and generalizability, we consider our algorithm to be an excellent candidate for implementation of real-space renormalization in higher dimensions, and discuss some of the details and the remaining challenges in 3D. \n \nSecond, we show how certain topological conformal defects of critical lattice theories can be represented as tensor networks, using the 2D classical Ising model as an example. Furthermore, we show how such tensor network descriptions, combined with a renormalization group algorithm, can be used to obtain accurate estimates of the universal properties of these defects. We also show how coarse-graining of defects can be applied to any conformal defect (i.e. not just topological ones), and yields a set of associated scaling dimensions. \n \nFinally, we leave behind the focus on renormalization group methods, and present a method for spatially resolving the overlap between two tensor network states, to obtain localized information about the similarities and differences between them. For a given region, the similarity of two states in this region can be quantified by the Uhlmann fidelity of their reduced density matrices, and we show how such fidelities can be efficiently computed in many cases when the two states are represented as tensor networks. We demonstrate the usefulness of evaluating such subsystem fidelities with three example applications: studying local quenches, comparing critical and non-critical states, and quantifying convergence in tensor network simulations.
We propose a scheme to perform tensor network based finite-size scaling analysis for two-dimensional classical models. In the tensor network representation of the partition function, we use higher-order tensor renormalization group (HOTRG) method to coarse grain the weight tensor. The renormalized tensor is then used to construct the approximated transfer matrix of an infinite strip of finite width. By diagonalizing the transfer matrix we obtain the correlation length, the magnetization, and the energy density, which are used in finite-size scaling analysis to determine the critical temperature and the critical exponents. As a benchmark we study the two-dimensional classical Ising model. We show that the critical temperature and the critical exponents can be accurately determined. With HOTRG bond dimension D=70D=70D=70, the absolute errors of the critical temperature Tc{T}_{c}Tc​ and the critical exponent $\ensuremath{\nu}$, $\ensuremath{\beta}$ are at the order of ${10}^{\ensuremath{-}7},{10}^{\ensuremath{-}5}$, ${10}^{\ensuremath{-}4}$, respectively. Furthermore, the results can be systematically improved by increasing the bond dimension of the HOTRG method. Finally, we study the length scale induced by the finite cutoff in bond dimension and elucidate its physical meaning in this context.
The study of low-dimensional, strongly-interacting quantum systems has been of interest in the past few decades due to new and exotic physics that show great potential in the advancement of fundamental physics as well as technological applications. In order to investigate such systems, a vast number of techniques have been developed throughout the years, all of which have their respective strengths and weaknesses. In the world of one-dimensional (1D) quantum systems, the density-matrix renormalization group (DMRG) algorithm and matrix product states (MPS) have proven to be powerful and reliable tools that provide invaluable information while providing a wide range of data that support both theoretical and experimental studies. Coupled with the development and refinement of tensor networks - an ansatz for quantum many-body wavefunctions, in particular MPS, the DMRG algorithm has seen a spike of improvements that has pushed the boundaries of its application into more sophisticated and complex systems.This thesis broadly covers the study of several 1D many-body quantum systems represented by infinite MPS (iMPS) - a class of ansatz that represent translationally-invariant, 1D many-body quantum states. More specifically, it is divided into two main parts.The first part investigates the 1D topological Kondo insulator (TKI). This is an effective model designed to investigate how strong interactions between conduction electrons and localized moments result in a symmetry-protected topological (SPT) phase, specifically the Haldane phase. By studying the effect of the electron repulsion as well as the competition between the local and non-local couplings between the electrons and the local moments, it is found that a topological phase transition from the SPT phase to a topologically trivial phase occurs with the assistance of electron interaction. The properties of both topologically trivial and nontrivial groundstates were revealed via means of quantum information theoretic quantities such as the entanglement entropy, entanglement spectrum and non-local order parameters. These quantities unveil the nature, structure and the effect that the different interactions have on the groundstate properties. Besides the phases, the properties of the critical point was studied and classified. By obtaining the critical exponents and central charge, the universality class of this transition was found to be that of 1D free fermions/bosons. Furthermore, the presence of electron interactions was found not to alter this universality class.The second part of this thesis is a project that stems from the necessity to overcome the inherent limitation of an iMPS in representing a system at a cusp of a quantum phase transition (QPT), specifically, in determining the critical point and exponents. In the thermodynamic limit, the laws of statistical mechanics dictates that the system’s correlation length diverges at the critical point. However, when representing a critical state with an iMPS, the finite bond dimension implies that the correlation length of the iMPS remains finite, albeit large. This presents a fundamental challenge in extracting critical data since the critical exponents are defined for systems in the thermodynamic limit. To overcome this shortcoming, finite-entanglement scaling (FES) - the analog of finite-size scaling, has previously been used to locate the critical point and extract the critical exponents for systems represented by finite-bond dimensional iMPS. While FES serves its purpose sufficiently well, the computational cost is high for just about any moderately complex, real-world system. To overcome such difficulties, the second part of this thesis combines new ideas of using higher-order cumulants of the order parameter with previously-known iMPS techniques to determine the critical point and extract the exponents, thus relating statistical mechanics of QPTs and tensor networks of critical states. Some of the main methods used and developed here are FES, the application of the Binder cumulant in iMPS and the new cumulant exponent relation. Putting these tools together provides a scheme that can be used to efficiently locate the critical point and extract the critical exponents at a lower computational cost than previously-known methods. This is shown through comparisons of several exemplary models such as the 1D and quasi-1D transverse field Ising model, the 1D TKI, the S = 1 Heisenberg chain with single-ion anisotropy and the 1D Bose-Hubbard model.