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We report an efficient program for computing the eigenvalues and symmetry-adapted eigenvectors of very large quaternionic (or Hermitian skew-Hamiltonian) matrices, using which structure-preserving diagonalization of matrices of dimension N…

Chemical Physics · Physics 2017-03-20 Toru Shiozaki

We develop a distributed Block Chebyshev-Davidson algorithm to solve large-scale leading eigenvalue problems for spectral analysis in spectral clustering. First, the efficiency of the Chebyshev-Davidson algorithm relies on the prior…

Machine Learning · Computer Science 2024-01-08 Qiyuan Pang , Haizhao Yang

Based on the spectral divide-and-conquer algorithm by Nakatsukasa and Higham [SIAM J. Sci. Comput., 35(3): A1325-A1349, 2013], we propose a new algorithm for computing all the eigenvalues and eigenvectors of a symmetric banded matrix. For…

Numerical Analysis · Mathematics 2018-01-22 Ana Šušnjara , Daniel Kressner

We present a new algorithm that computes eigenvalues and eigenvectors of a Hermitian positive definite matrix while solving a linear system of equations with Conjugate Gradient (CG). Traditionally, all the CG iteration vectors could be…

High Energy Physics - Lattice · Physics 2011-10-12 Andreas Stathopoulos , Kostas Orginos

Let $A$ be a $n\times n$ complex Hermitian matrix and let $\lambda(A)=(\lambda_1,\ldots,\lambda_n)\in \mathbb{R}^n$ denote the eigenvalues of $A$, counting multiplicities and arranged in non-increasing order. Motivated by problems arising…

Functional Analysis · Mathematics 2021-04-15 Pedro Massey , Demetrio Stojanoff , Sebastian Zarate

Recent work has shown that the (block) Lanczos algorithm can be used to extract approximate energy spectra and matrix elements from (matrices of) correlation functions in quantum field theory, and identified exact coincidences between…

High Energy Physics - Lattice · Physics 2025-03-24 Ryan Abbott , Daniel C. Hackett , George T. Fleming , Dimitra A. Pefkou , Michael L. Wagman

We consider the hermitian random matrix model with external source and general polynomial potential, when the source has two distinct eigenvalues but is otherwise arbitrary. All such models studied so far have a common feature: an…

Mathematical Physics · Physics 2020-12-11 Andrei Martínez-Finkelshtein , Guilherme L. F. Silva

Horn's problem -- to find the support of the spectrum of eigenvalues of the sum $C=A+B$ of two $n$ by $n$ Hermitian matrices whose eigenvalues are known -- has been solved by Knutson and Tao. Here the probability distribution function (PDF)…

Mathematical Physics · Physics 2018-09-13 Jean-Bernard Zuber

Kohn-Sham density functional theory calculations using conventional diagonalization based methods become increasingly expensive as temperature increases due to the need to compute increasing numbers of partially occupied states. We present…

Chemical Physics · Physics 2022-03-23 Qimen Xu , Xin Jing , Boqin Zhang , John E. Pask , Phanish Suryanarayana

This work introduces a method for determining the energy spectrum of lattice quantum chromodynamics (LQCD) by applying the Lanczos algorithm to the transfer matrix and using a bootstrap generalization of the Cullum-Willoughby method to…

High Energy Physics - Lattice · Physics 2025-05-09 Michael L. Wagman

Jacobian and Hessian regularization aim to reduce the magnitude of the first and second-order partial derivatives with respect to neural network inputs, and they are predominantly used to ensure the adversarial robustness of image…

Machine Learning · Computer Science 2022-12-02 Chenwei Cui , Zehao Yan , Guangshen Liu , Liangfu Lu

Recent work found that an analysis formalism based on the Lanczos algorithm allows energy levels to be extracted from Euclidean correlation functions with faster ground-state convergence than effective masses, convergent estimators for…

High Energy Physics - Lattice · Physics 2025-09-12 Daniel C. Hackett , Michael L. Wagman

We study fast algorithms for computing fundamental properties of a positive semidefinite kernel matrix $K \in \mathbb{R}^{n \times n}$ corresponding to $n$ points $x_1,\ldots,x_n \in \mathbb{R}^d$. In particular, we consider estimating the…

Data Structures and Algorithms · Computer Science 2021-06-21 Arturs Backurs , Piotr Indyk , Cameron Musco , Tal Wagner

Given a random quantum state of multiple distinguishable or indistinguishable particles, we provide an effective method, rooted in symplectic geometry, to compute the joint probability distribution of the eigenvalues of its one-body reduced…

Quantum Physics · Physics 2014-10-21 Matthias Christandl , Brent Doran , Stavros Kousidis , Michael Walter

Two numerical algorithms for the computation of eigenvalues of Dirac operators in lattice gauge theories are described: one is an accelerated conjugate gradient method, the other one a standard Lanczos method. Results obtained by Cullum's…

High Energy Physics - Lattice · Physics 2009-10-28 Thomas Kalkreuter

We discuss a spectral method for the numerical solution of the Vlasov-Poisson system where the velocity space is decomposed by means of an Hermite basis. We describe a semi-implicit time discretization that extends the range of numerical…

Plasma Physics · Physics 2013-12-19 Enrico Camporeale , Gian Luca Delzanno , Benjamin K. Bergen , J. David Moulton

The eigenvalue density of a matrix plays an important role in various types of scientific computing such as electronic-structure calculations. In this paper, we propose a quantum algorithm for computing the eigenvalue density in a given…

Quantum Physics · Physics 2021-12-13 Yasunori Futamura , Xiucai Ye , Tetsuya Sakurai

Numerous methods for computing conformal mesh paramterizations has been developed due to the vast applications in the field of geometry processing. Spectral conformal parameterization (SCP) is one of these methods to computing a quality…

Numerical Analysis · Mathematics 2016-11-26 Wei-Qiang Huang , Xianfeng David Gu , Wen-Wei Lin , Shing-Tung Yau

This paper proposes a probabilistic deep metric learning (PDML) framework for hyperspectral image classification, which aims to predict the category of each pixel for an image captured by hyperspectral sensors. The core problem for…

Computer Vision and Pattern Recognition · Computer Science 2022-11-16 Chengkun Wang , Wenzhao Zheng , Xian Sun , Jiwen Lu , Jie Zhou

This paper introduces a novel approach to probabilistic deep learning, kernel density matrices, which provide a simpler yet effective mechanism for representing joint probability distributions of both continuous and discrete random…

Machine Learning · Computer Science 2024-05-01 Fabio A. González , Raúl Ramos-Pollán , Joseph A. Gallego-Mejia
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