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arXiv:2405.19904 · Physical review. E

Statistical physics of principal minors: Cavity approach

Abolfazl Ramezanpour, M. A. Rajabpour

Published Jun 18, 2024• 0 citations
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Abstract

Determinants are useful to represent the state of an interacting system of (effectively) repulsive and independent elements, like fermions in a quantum system and training samples in a learning problem. A computationally challenging problem is to compute the sum of powers of principal minors of a matrix which is relevant to the study of critical behaviors in quantum fermionic systems and finding a subset of maximally informative training data for a learning algorithm. Specifically, principal minors of positive square matrices can be considered as statistical weights of a random point process on the set of the matrix indices. The probability of each subset of the indices is in general proportional to a positive power of the determinant of the associated submatrix. We use Gaussian representation of the determinants for symmetric and positive matrices to estimate the partition function (or free energy) and the entropy of principal minors within the Bethe approximation. The results are expected to be asymptotically exact for diagonally dominant matrices with locally treelike structures. We consider the Laplacian matrix of random regular graphs of degree K=2,3,4 and exactly characterize the structure of the relevant minors in a mean-field model of such matrices. No (finite-temperature) phase transition is observed in this class of diagonally dominant matrices by increasing the positive power of the principal minors, which here plays the role of an inverse temperature.

DOI
10.1103/physreve.109.064141

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Determinants are useful to represent the state of an interacting system of (effectively) repulsive and independent elements, like fermions in a quantum system and training samples in a learning problem. A computationally challenging problem is to compute the sum of powers of principal minors of a matrix which is relevant to the study of critical behaviors in quantum fermionic systems and finding a subset of maximally informative training data for a learning algorithm. Specifically, principal minors of positive square matrices can be considered as statistical weights of a random point process on the set of the matrix indices. The probability of each subset of the indices is in general proportional to a positive power of the determinant of the associated submatrix. We use Gaussian representation of the determinants for symmetric and positive matrices to estimate the partition function (or free energy) and the entropy of principal minors within the Bethe approximation. The results are expected to be asymptotically exact for diagonally dominant matrices with locally treelike structures. We consider the Laplacian matrix of random regular graphs of degree K=2,3,4 and exactly characterize the structure of the relevant minors in a mean-field model of such matrices. No (finite-temperature) phase transition is observed in this class of diagonally dominant matrices by increasing the positive power of the principal minors, which here plays the role of an inverse temperature.
Given a locally consistent set of reduced density matrices, we construct approximate density matrices which are globally consistent with the local density matrices we started from when the trial density matrix has a tree structure. We employ the cavity method of statistical physics to find the optimal density matrix representation by slowly decreasing the temperature in an annealing algorithm, or by minimizing an approximate Bethe free energy depending on the reduced density matrices and some cavity messages originated from the Bethe approximation of the entropy. We obtain the classical Bethe expression for the entropy within a naive (mean-field) approximation of the cavity messages, which is expected to work well at high temperatures. In the next order of the approximation, we obtain another expression for the Bethe entropy depending only on the diagonal elements of the reduced density matrices. In principle, we can improve the entropy approximation by considering more accurate cavity messages in the Bethe approximation of the entropy. We compare the annealing algorithm and the naive approximation of the Bethe entropy with exact and approximate numerical simulations for small and large samples of the random transverse Ising model on random regular graphs.
The computation of determinants plays a central role in diagrammatic Monte Carlo algorithms for strongly correlated systems. The evaluation of large numbers of determinants can often be the limiting computational factor determining the number of attainable diagrammatic expansion orders. In this work we build on the algorithm presented in [K. Griffin and M. J. Tsatsomeros, Principal minors, part i: A method for computing all the principal minors of a matrix, Linear Algebra Appl. 419, 107 (2006)] which computes all principal minors of a matrix in O(2n)O({2}^{n})O(2n) operations. We present multiple generalizations of the algorithm to the efficient evaluation of certain subsets of all principal minors with immediate applications to connected determinant diagrammatic Monte Carlo within the normal and symmetry-broken phases as well as continuous-time quantum Monte Carlo. Additionally, we improve the asymptotic scaling of diagrammatic Monte Carlo formulated in real time to O(2n)O({2}^{n})O(2n) and report speedups of up to a factor 25 at computationally realistic expansion orders. We further show that all permanent principal minors, corresponding to sums of bosonic Feynman diagrams, can be computed in O(3n)O({3}^{n})O(3n), thus encouraging the investigation of bosonic and mixed systems by means of diagrammatic Monte Carlo.
To estimate the degree of quantum entanglement of random pure states, it is crucial to understand the statistical behavior of entanglement indicators such as the von Neumann entropy, quantum purity, and entanglement capacity. These entanglement metrics are functions of the spectrum of density matrices, and their statistical behavior over different generic state ensembles have been intensively studied in the literature. As an alternative metric, in this work, we study the sum of the square root spectrum of density matrices, which is relevant to negativity and fidelity in quantum information processing. In particular, we derive the finite-size mean and variance formulas of the sum of the square root spectrum over the Bures-Hall ensemble, extending known results obtained recently over the Hilbert-Schmidt ensemble.
The following thesis focuses on the scaling of entanglement entropy in lower dimensions and is divided into three main parts. Chapter 2 studies the thermal reduced density matrices in fermion and spin systems on ladders. Chapter 3 studies the many-body localization phase transition in a Rokhsar-Kivelson type wave function. Chapter 4 studies the subleading correction term of entanglement entropy in 2+1 dimensional scale invariant systems. Chapter 5 studies the bulk-boundary correspondence in 3 + 1 dimensional topological phases and its entanglement entropy. In chapter 2, we investigate the reduced density matrices for a model of free fermions on a two-leg ladder (gapped by the inter-chain tunneling operator) and in 1/2 spin systems on a ladder with a gapped ground state using exact solutions and several controlled approximations. We calculate the reduced density matrix and the entanglement entropy for a leg of the ladder (i.e. cut made between the chains). In the fermionic system we find the exact form of the reduced density matrix for one of the chains and determine the entanglement spectrum explicitly. Here we find that in the weak tunneling limit of the ladder the entanglement entropy of one chain of the gapped ladder has a simple and universal form dictated by conformal invariance. In the case of the spin system, we consider the strong coupling limit by using perturbation theory and get the reduced density matrix by the Schmidt decomposition. The entanglement entropies of a general gapped system of two coupled conformal field theories (in 1+1 dimensions) is discussed using the replica trick and scaling arguments. We show that 1) for a system with a bulk gap, the reduced density matrix has the form of a thermal density matrix, 2) the long-wavelength modes of one subsystem (a chain) of a gapped coupled system are always thermal, 3) the von Neumann entropy equals to the thermodynamic entropy of one chain, and 4) the bulk gap plays the role of effective temperature. In chapter 3, we construct a family of many-body wave functions to study the many-body localization phase transition. The wave functions have a Rokhsar-Kivelson form, in which the weight for the configurations are chosen from the Gibbs weights of a classical spin glass model, known as the Random Energy Model, multiplied by a random sign structure to represent a highly excited state. These wave functions show a phase transition into an MBL phase. In addition, we see three regimes of entanglement scaling with subsystem size: scaling with entanglement corresponding to an infinite temperature thermal phase, constant scaling, and a sub-extensive scaling between these limits. Near the phase transition point, the fluctuations of the Renyi entropies are non-Gaussian. We find that Renyi entropies with different Renyi index transition into the MBL phase at different points and have different scaling behavior, suggesting a multifractal behavior. In chapter 4, we study the universal scaling behavior of the entanglement entropy of critical theories in 2+1 dimensions. We specially consider two fermionic scale-invariant models, free massless Dirac fermions and a model of fermions with quadratic band touching, and numerically study the two-cylinder entanglement entropy of the models on the torus. We find that in both cases the entanglement entropy satisfies the area law and has the subleading term which is a scaling function of the aspect ratios of the cylindrical regions. We test the scaling of entanglement in both the free fermion models using three possible scaling functions for the subleading term derived from a) the quasi-one-dimensional conformal field theory, b) the bosonic quantum Lifshitz model, and c) the holographic AdS/CFT correspondence. For the later case we construct an analytic scaling function using holography, appropriate for critical theories with a gravitational dual description. We find that the subleading term in the fermionic models is well described, for a range of aspect ratios, by the scaling form derived from the quantum Lifshitz model as well as that derived using the AdS/CFT correspondence (in this case only for the Dirac model). For the case where the fermionic models are placed on a square torus we find the fit to the different scaling forms is in agreement to surprisingly high precision. In chapter 5, we discuss (2+1)-dimensional gapless surface theories of bulk (3+1)-dimensional topological phases, such as the BF theory at level K, and its generalization. In particular, we put these theories on a flat (2+1) dimensional torus T3 parameterized by its modular parameters, and compute the partition functions obeying various twisted boundary conditions. We show the partition functions are transformed into each other under SL(3, Z) modular transformations, and furthermore establish the bulk-boundary correspondence in (3+1) dimensions by matching the modular S and T matrices computed from the boundary field theories with those computed in the bulk. We propose the three-loop braiding statistics can be studied by constructing the modular S and T matrices from an appropriate boundary field theory. We also study the EE for 3 + 1- dimensional topological phase with or without three-loop braiding phase.
We propose an exact summation method to compute thermodynamic observables in integrable quantum field theories. The key idea is to use the matrix-tree theorem to write the Gaudin determinants that appear in the cluster expansion as a sum over graphs. For theories with a diagonal S-matrix, this method is more powerful than the standard Thermodynamic Bethe Ansatz (TBA) technique as it is exact to all orders of powers in inverse volume. We have obtained using this method the TBA equation, the excited state energies in finite volume, the Leclair-Mussardo formula for one point functions, the finite-temperature boundary entropy and cumulants of conserved charges in Generalized Gibbs Ensembles. Moreover, the graph expansion can also be regarded as an alternative to algebraic manipulations involving Gaudin determinants. We have applied this idea to derive the equations of state and other transport properties in Generalized Hydrodynamics. For theories with a non-diagonal S-matrix, the description of a complete set of states is more involved and it is not known how a cluster expansion can be implemented. It is nevertheless possible to apply the direct summation method in reverse and interpret known TBA equations with complex strings in terms of diagrams.
Stabilizer Rényi entropy quantifies the nonstabilizerness of a quantum state through Rényi moments of its Pauli expectation-value distribution. Its standard form sums over Pauli-string degrees and retains only the total Rényi weight. We introduce a fugacity-resolved partition function for the critical transverse-field Ising chain that resolves this degree in the balanced Majorana representation and generates its full counting statistics. This Ising problem extends beyond a single model: exact decimation identities and the correspondence with the half-filled XXXXXX chain establish it as a common finite-size building block for stabilizer and computational-basis Shannon--Rényi entropies. We map the fugacity-resolved all-minors sum, for every positive Rényi index, to a checkerboard-weighted discrete Selberg ensemble on a half-filled doubled root lattice. For positive integer indices, it reduces to a finite aliased Dyson constant term. At α=12,1,2α=\tfrac12,1,2α=21​,1,2, determinant and Pfaffian compressions yield product formulas. At α=4α=4α=4, the generic-fugacity problem admits an exact inverse Jack--Kostka representation, while at unit fugacity a complementary middle-minor identity relates it to the square of the α=2α=2α=2 result. These generating functions determine the balanced-degree statistics. Complement symmetry makes the distribution symmetric about k=L/2k=L/2k=L/2, with an index-dependent width. It is exactly binomial at α=1α=1α=1, has variance proportional to LLL at α=12α=\tfrac12α=21​, and develops an Llog⁡LL\log LLlogL enhancement at α=2α=2α=2. After variance rescaling, the centered distributions converge to Gaussian limits at all three indices. Beyond these solvable cases, finite-size numerics reveal an evolution from a central peak to a symmetric bimodal profile and eventually to endpoint dominance as the Rényi index increases.