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We improve the convergence of the Lanczos algorithm using the matrix product state representation. As an alternative to the density matrix renormalization group (DMRG), the Lanczos algorithm avoids local minima and can directly find…

强关联电子 · 物理学 2025-12-22 Yu Wang , Zhangyu Yang , Xingyao Wu , Christian B. Mendl

The fabrication, utilisation, and efficiency of quantum technologies rely on a good understanding of quantum thermodynamic properties. Many-body systems are often used as hardware for these quantum devices, but interactions between…

强关联电子 · 物理学 2022-04-26 Krissia Zawadzki , Amy Skelt , Irene D'Amico

We introduce a systematic construction of higher-order matrix product operator (MPO) approximations of the time evolution operator for generic (short and long range) one-dimensional Hamiltonians. We demonstrate the utility of our…

强关联电子 · 物理学 2023-03-01 Maarten Van Damme , Jutho Haegeman , Ian McCulloch , Laurens Vanderstraeten

We introduce an algorithm for estimating the trace of a matrix function $f(\mathbf{A})$ using implicit products with a symmetric matrix $\mathbf{A}$. Existing methods for implicit trace estimation of a matrix function tend to treat…

数值分析 · 数学 2023-08-30 Tyler Chen , Eric Hallman

We present a simple derivation of the Hellmann-Feynman theorem at finite temperature. We illustrate its validity by considering three relevant examples which can be used in quantum mechanics lectures: the one-dimensional harmonic…

量子物理 · 物理学 2020-06-24 Marina Pons , Bruno Juliá-Díaz , Arnau Rios , Isaac Vidaña , Artur Polls

We combine matrix product operator techniques with Chebyshev polynomial expansions and present a method that is able to explore spectral properties of quantum many-body Hamiltonians. In particular, we show how this method can be used to…

量子物理 · 物理学 2020-03-18 Yilun Yang , Sofyan Iblisdir , J. Ignacio Cirac , Mari Carmen Bañuls

The computation of a matrix function $f(A)$ is an important task in scientific computing appearing in machine learning, network analysis and the solution of partial differential equations. In this work, we use only matrix-vector products…

数值分析 · 数学 2026-03-03 Taejun Park , Yuji Nakatsukasa

The approximate representation of operators by finite matrices is analysed in terms of accuracy and convergence. The identity operator, for example, can be reconstructed using a basis of harmonic oscillator states leading to a narrow peak…

数学物理 · 物理学 2025-12-02 B. G. Giraud , S. Karataglidis , K. Murulane , R. Peschanski

We review existing methods for implementing smooth functions f(A) of a sparse Hermitian matrix A on a quantum computer, and analyse a further combination of these techniques which has some advantages of simplicity and resource consumption…

量子物理 · 物理学 2019-08-23 Sathyawageeswar Subramanian , Steve Brierley , Richard Jozsa

We describe a Lanczos-based algorithm for approximating the product of a rational matrix function with a vector. This algorithm, which we call the Lanczos method for optimal rational matrix function approximation (Lanczos-OR), returns the…

数值分析 · 数学 2023-06-01 Tyler Chen , Anne Greenbaum , Cameron Musco , Christopher Musco

We consider a Trotter-type-product formula for approximating the solution of a linear abstract Cauchy problem (given by a strongly continuous semigroup), where the underlying Banach space is a product of two spaces. In contrast to the…

泛函分析 · 数学 2023-07-04 Artur Stephan

We obtain an expression for the error in the approximation of $f(A) \boldsymbol{b}$ and $\boldsymbol{b}^T f(A) \boldsymbol{b}$ with rational Krylov methods, where $A$ is a symmetric matrix, $\boldsymbol{b}$ is a vector and the function $f$…

数值分析 · 数学 2023-11-07 Igor Simunec

In this work, we consider the approximation of Hilbert space-valued meromorphic functions that arise as solution maps of parametric PDEs whose operator is the shift of an operator with normal and compact resolvent, e.g. the Helmholtz…

数值分析 · 数学 2020-02-28 Francesca Bonizzoni , Fabio Nobile , Ilaria Perugia , Davide Pradovera

Solving high-dimensional partial differential equations necessitates methods free of exponential scaling in the dimension of the problem. This work introduces a tensor network approach for the Kolmogorov backward equation via approximating…

数值分析 · 数学 2024-04-24 Xun Tang , Leah Collis , Lexing Ying

Hamiltonian Monte Carlo (HMC) is a powerful Markov chain Monte Carlo (MCMC) method for performing approximate inference in complex probabilistic models of continuous variables. In common with many MCMC methods, however, the standard HMC…

统计计算 · 统计学 2017-04-12 Matthew M. Graham , Amos J. Storkey

This work presents a tensorial approach to constructing data-driven reduced-order models corresponding to semi-discrete partial differential equations with canonical Hamiltonian structure. By expressing parameter-varying operators with…

数值分析 · 数学 2025-05-14 Arjun Vijaywargiya , Shane A. McQuarrie , Anthony Gruber

We analyze the many-particle Schrodinger equation for fermions in a thermal ensemble by introducing an exponential operator expansion, defined in the context of thermofield dynamics. The expansion is optimized variationally at each time…

统计力学 · 物理学 2020-01-10 Edward B. Baker

A method for approximate solution of initial value and spectral problems for one dimensional Dirac equation based on an analytic approximation of the transmutation operator is presented. In fact the problem of numerical approximation of…

经典分析与常微分方程 · 数学 2021-01-29 Nelson Gutiérrez Jiménez , Sergii M. Torba

We provide an efficient approximation for the exponential of a local operator in quantum spin systems using tensor-network representations of a cluster expansion. We benchmark this cluster tensor network operator (cluster TNO) for…

强关联电子 · 物理学 2021-12-03 Bram Vanhecke , David Devoogdt , Frank Verstraete , Laurens Vanderstraeten

Computation of the trace of a matrix function plays an important role in many scientific computing applications, including applications in machine learning, computational physics (e.g., lattice quantum chromodynamics), network analysis and…

数据结构与算法 · 计算机科学 2017-03-10 Insu Han , Dmitry Malioutov , Haim Avron , Jinwoo Shin