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A linear algebraic method named the shifted conjugate-orthogonal-conjugate-gradient method is introduced for large-scale electronic structure calculation. The method gives an iterative solver algorithm of the Green's function and the…

Materials Science · Physics 2007-05-23 R. Takayama , T. Hoshi , T. Sogabe , S. -L. Zhang , T. Fujiwara

One- and two-dimensional operators which originate from the asymptotic form of the three-body Coulomb wave equation in parabolic coordinates are treated within the context of square integrable basis set. The matrix representations of…

Quantum Physics · Physics 2009-11-13 S. A. Zaytsev

Recently, a functional integral representation was proposed by Weller (Weller, W.: phys.~stat.~sol.~(b) {\bf 162}, 251 (1990)), in which the fermionic fields strictly satisfy the constraint of no double occupancy at each lattice site. This…

Condensed Matter · Physics 2009-10-22 R. Bulla , J. Keller , T. Pruschke

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

The electromagnetic Green's function is a crucial ingredient for the theoretical study of modern photonic quantum devices, but is often difficult or even impossible to calculate directly. We present a numerically efficient framework for…

Mesoscale and Nanoscale Physics · Physics 2026-04-15 Robert Meiners Fuchs , Juanjuan Ren , Stephen Hughes , Marten Richter

Green's function provides an inherent connection between theoretical analysis and numerical methods for elliptic partial differential equations, and general absence of its closed-form expression necessitates surrogate modeling to guide the…

Numerical Analysis · Mathematics 2025-09-16 Qi Sun , Shengyan Li , Bowen Zheng , Lili Ju , Xuejun Xu

We propose a quadrature-based formula for computing the exponential function of matrices with a non-oscillatory integral on an infinite interval and an oscillatory integral on a finite interval. In the literature, existing quadrature-based…

Numerical Analysis · Mathematics 2024-12-02 Masato Suzuki , Ken'ichiro Tanaka

Large classes of materials systems in physics and engineering are governed by magnetic and electrostatic interactions. Continuum or mesoscale descriptions of such systems can be cast in terms of integral equations, whose direct…

Computational Physics · Physics 2016-08-15 Xikai Jiang , Jiyuan Li , Xujun Zhao , Jian Qin , Dmitry Karpeev , Juan Hernandez-Ortiz , Juan de Pablo , Olle Heinonen

We compute unbiased spectral functions of the two-dimensional Hubbard model by extrapolating Green functions, obtained from determinantal quantum Monte Carlo simulations, to the thermodynamic and continuous time limits. Our results clearly…

Strongly Correlated Electrons · Physics 2012-10-09 D. Rost , E. V. Gorelik , F. Assaad , N. Blümer

We develop a stochastic resolution of identity approach to the real-time second-order Green's function (real-time sRI-GF2) theory, extending our recent work for imaginary-time Matsubara Green's function {\em J. Chem. Phys.} {\bf 151},…

Chemical Physics · Physics 2019-09-17 Wenjie Dou , Tyler Y. Takeshita , Ming Chen , Roi Baer , Daniel Neuhauser , Eran Rabani

We have studied possible applications of a particular pseudo-differential algebra in singular analysis for the construction of fundamental solutions and Green's functions of a certain class of elliptic partial differential operators. The…

Analysis of PDEs · Mathematics 2023-12-19 Heinz-Jürgen Flad , Gohar Flad-Harutyunyan

While recent advancements in Neural Ranking Models have resulted in significant improvements over traditional statistical retrieval models, it is generally acknowledged that the use of large neural architectures and the application of…

Information Retrieval · Computer Science 2025-05-13 Sourav Saha , Harsh Agarwal , V Venktesh , Avishek Anand , Swastik Mohanty , Debapriyo Majumdar , Mandar Mitra

We propose a general framework for computing Retarded Green's Functions (RGFs) on quantum computers by recasting their evaluation as a problem of circuit differentiation. Our proposal is based on real-time evolution and specifically…

Quantum Physics · Physics 2026-04-15 Samuele Piccinelli , Francesco Tacchino , Ivano Tavernelli , Giuseppe Carleo

For an easy use of model order reduction techniques in applications, software solutions are needed. In this paper, we describe the MORLAB, Model Order Reduction LABoratory, toolbox as an efficient implementation of model reduction…

Mathematical Software · Computer Science 2021-09-07 Peter Benner , Steffen W. R. Werner

Simulations of finite temperature quantum systems provide imaginary frequency Green's functions that correspond one-to-one to experimentally measurable real-frequency spectral functions. However, due to the bad conditioning of the…

Strongly Correlated Electrons · Physics 2021-02-10 Jiani Fei , Chia-Nan Yeh , Emanuel Gull

We present the TRIQS library, a Toolbox for Research on Interacting Quantum Systems. It is an open-source, computational physics library providing a framework for the quick development of applications in the field of many-body quantum…

Strongly Correlated Electrons · Physics 2016-09-12 Olivier Parcollet , Michel Ferrero , Thomas Ayral , Hartmut Hafermann , Igor Krivenko , Laura Messio , Priyanka Seth

We find a relation between the semiclassical approximation of the temperature (Matsubara) 2-point correlator and the corresponding classical Green function in real time at finite temperature. The anharmonic oscillator at finite temperature…

High Energy Physics - Phenomenology · Physics 2009-12-30 A. Bochkarev

Implicit Neural Representations (INRs) have emerged as a paradigm in knowledge representation, offering exceptional flexibility and performance across a diverse range of applications. INRs leverage multilayer perceptrons (MLPs) to model…

Computer Vision and Pattern Recognition · Computer Science 2025-02-19 Amer Essakine , Yanqi Cheng , Chun-Wun Cheng , Lipei Zhang , Zhongying Deng , Lei Zhu , Carola-Bibiane Schönlieb , Angelica I Aviles-Rivero

In this paper, we propose a novel approach to obtaining a reliable and simple mathematical model of a dielectrophoretic force for model-based feedback micromanipulation. Any such model is expected to sufficiently accurately relate the…

Computational Physics · Physics 2017-09-13 Martin Gurtner , Kristian Hengster-Movric , Zdeněk Hurák

We provide explicit representations of Green's functions for general linear fractional differential operators with {\it variable coefficients} and Riemann-Liouvilles derivatives. We assume that all their coefficients are continuous in $[0,…

Mathematical Physics · Physics 2013-09-05 Myong-Ha Kim , Hyong-Chol O