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The exact conditions for density functionals and density matrix functionals in terms of fractional charges and fractional spins are known, and their violation in commonly used functionals has been shown to be the root of many major failures…

Other Condensed Matter · Physics 2015-06-16 Weitao Yang , Paula Mori-Sanchez , Aron J. Cohen

A stochastic method is described for estimating Green's functions (GF's), appropriate to linear advection-diffusion-reaction transport problems, evolving in arbitrary geometries. By allowing straightforward construction of approximate,…

Learning the Green's function using deep learning models enables to solve different classes of partial differential equations. A practical limitation of using deep learning for the Green's function is the repeated computationally expensive…

Machine Learning · Computer Science 2023-08-02 Kishan Wimalawarne , Taiji Suzuki , Sophie Langer

This paper presents a stochastic approach to theorems concerning the behavior of iterations of the Bernstein operator $B_n$ taking a continuous function $f \in C[0,1]$ to a degree-$n$ polynomial when the number of iterations $k$ tends to…

Probability · Mathematics 2016-01-19 Takis Konstantopoulos , Linglong Yuan , Michael A. Zazanis

This article is devoted to deduce the expression of the Green's function related to a general constant coefficients fractional difference equation coupled to Dirichlet conditions. In this case, due to the points where some of the fractional…

Classical Analysis and ODEs · Mathematics 2022-12-20 Alberto Cabada , Nikolay D. Dimitrov , Jagan Mohan Jonnalagadda

We consider a general class of approximations which guarantees the conservation of particle number in many-body perturbation theory. To do this we extend the concept of $\Phi$-derivability for the self-energy $\Sigma$ to a larger class of…

Strongly Correlated Electrons · Physics 2016-09-15 Daniel Karlsson , Robert van Leeuwen

A common approach to approximating quadratic forms of matrix functions is to use a quadrature rule derived from the Lanczos process, known as a Lanczos quadrature. Although symmetric quadrature rules are computationally favorable, it has…

Numerical Analysis · Mathematics 2026-01-30 Wenhao Li , Shengxin Zhu

An end-to-end strategy for hybrid quantum-classical computations of Green's functions in many-body systems is presented and applied to the pairing model. The scheme makes explicit use of the spectral representation of the Green's function,…

Nuclear Theory · Physics 2026-05-01 Samuel Aychet-Claisse , Denis Lacroix , Vittorio Somà , Jing Zhang

Many of the input-parameter-to-output-quantity-of-interest maps that arise in computational science admit a surprising low-dimensional structure, where the outputs vary primarily along a handful of directions in the high-dimensional input…

Numerical Analysis · Mathematics 2019-05-13 Andrew Glaws , Paul G. Constantine

High-order derivatives of Green's functions are a key ingredient in Taylor-based fast multipole methods, Barnes-Hut $n$-body algorithms, and quadrature by expansion (QBX). In these settings, derivatives underpin either the formation,…

Computational Engineering, Finance, and Science · Computer Science 2026-04-01 Hirish Chandrasekaran , Andreas Kloeckner

We use a diagrammatic hopping expansion to calculate finite-temperature Green functions of the Bose-Hubbard model which describes bosons in an optical lattice. This technique allows for a summation of subsets of diagrams, so the divergence…

Statistical Mechanics · Physics 2013-05-30 Matthias Ohliger , Axel Pelster

We present a combination method based on orignal version of Davidson algorithm for extracting few of the lowest eigenvalues and eigenvectors of a sparse symmetric Hamiltonian matrix and the simplest version of Lanczos technique for…

Strongly Correlated Electrons · Physics 2014-09-12 Medha Sharma , M. A. H. Ahsan

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…

Numerical Analysis · Mathematics 2023-06-01 Tyler Chen , Anne Greenbaum , Cameron Musco , Christopher Musco

Polynomial Krylov subspace methods are among the most widely used methods for approximating $f(A)b$, the action of a matrix function on a vector, in particular when $A$ is large and sparse. When $A$ is Hermitian positive definite, the…

Numerical Analysis · Mathematics 2025-03-07 Marcel Schweitzer

Analytic continuation is a critical step in quantum many-body computations, connecting imaginary-time or Matsubara Green's functions with real-frequency spectral functions, which can be directly compared to experimental results. However,…

Strongly Correlated Electrons · Physics 2025-03-21 Li Huang , Changming Yue

In this article we derive the average and the variance of the cross-correlation of a noise wavefield. The noise cross-correlation function (NCF) is widely used to passively estimate the Green's function between two probes and is…

Disordered Systems and Neural Networks · Physics 2015-06-17 Julien de Rosny , Matthieu Davy

We examined the properties of the coefficients of the \cite{lanczos1964} approximation of the $\Gamma$-function with complex values of the free parameter together with the convergence properties of the approximation when using these…

Numerical Analysis · Mathematics 2020-05-22 William Rea

The accuracy of the forward scattering approximation for two-point Green's functions of the Anderson localization model on the Cayley tree is studied. A relationship between the moments of the Green's function and the largest eigenvalue of…

Disordered Systems and Neural Networks · Physics 2022-02-02 P. A. Nosov , I. M. Khaymovich , A. Kudlis , V. E. Kravtsov

In a recent series of scanning probe experiments, it became possible to visualize local electron flow in a two-dimensional electron gas. In this paper, a Green's function technique is presented that enables efficient calculation of the…

Mesoscale and Nanoscale Physics · Physics 2009-11-10 G. Metalidis , P. Bruno

We address the problem of analytic continuation of imaginary-frequency Green's functions, which is crucial in many-body physics, using machine learning based on a multi-level residual neural network. We specifically address potential biases…

Strongly Correlated Electrons · Physics 2022-11-24 Rong Zhang , Maximilian E. Merkel , Sophie Beck , Claude Ederer