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We present two related techniques to measure the two-point correlation function and the power spectrum with edge correction in any spatial dimensions. The underlying algorithm uses fast Fourier transforms for calculating the two-point…

Astrophysics · Physics 2009-11-11 István Szapudi , Jun Pan , Simon Prunet , Tamás Budavári

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 present a new straightforward principal component analysis (PCA) method based on the diagonalization of the weighted variance-covariance matrix through two spectral decomposition methods: power iteration and Rayleigh quotient iteration.…

Instrumentation and Methods for Astrophysics · Physics 2014-12-16 Ludovic Delchambre

The power method is one of the most fundamental tools for extracting top principal components from data through low-rank matrix approximation. Yet, when the target rank is large, the cost of matrix multiplication associated with this…

Numerical Analysis · Mathematics 2026-05-12 Shabarish Chenakkod , Michał Dereziński

In this paper, we give several matrix representations for the Horadam quaternions. We derive several identities related to these quaternions by using the matrix method. Since quaternion multiplication is not commutative, some of our results…

Number Theory · Mathematics 2019-10-10 Elif Tan , Ho-Hon Leung

Solving the generalized eigenvalue problem is a useful method for finding energy eigenstates of large quantum systems. It uses projection onto a set of basis states which are typically not orthogonal. One needs to invert a matrix whose…

Nuclear Theory · Physics 2023-04-05 Caleb Hicks , Dean Lee

Optical properties of materials related to light absorption and scattering are explained by the excitation of electrons. The Bethe-Salpeter equation is the state-of-the-art approach to describe these processes from first principles (ab…

Numerical Analysis · Mathematics 2020-08-21 Peter Benner , Carolin Penke

A powerful method for calculating the eigenvalues of a Hamiltonian operator consists of converting the energy eigenvalue equation into a matrix equation by means of an appropriate basis set of functions. The convergence of the method can be…

Quantum Physics · Physics 2007-05-23 Paolo Amore , Alfredo Aranda , Francisco Fernandez , Hugh Jones

In this paper, we propose a spectral framework that embeds 1D and 2D quasiperiodic Helmholtz eigenvalue problems into higher-dimensional (2D and 4D) periodic spaces via the projection method \cite{jiang2014numerical, jiang2024numerical}. To…

Numerical Analysis · Mathematics 2026-05-28 Teng-Chao Sun , Tiexiang Li , Wen-Wei Lin , Xing-Long Lyu

We present a new approach to compute selected eigenvalues and eigenvectors of the two-parameter eigenvalue problem. Our method requires computing generalized eigenvalue problems of the same size as the matrices of the initial two-parameter…

Numerical Analysis · Mathematics 2021-05-12 Henrik Eisenmann , Yuji Nakatsukasa

The computation of the dominant eigenpair for symmetric positive semidefinite matrices is fundamental in numerical optimization. This work shifts the paradigm from the classical Rayleigh quotient to an unconstrained difference formulation,…

Optimization and Control · Mathematics 2026-05-26 Xiaozhi Liu , Mengmeng Song , Yong Xia

We propose a novel numerical algorithm for computing the electronic structure related eigenvalue problem of incommensurate systems. Unlike the conventional practice that approximates the system by a large commensurate supercell, our…

Numerical Analysis · Mathematics 2019-03-27 Yuzhi Zhou , Huajie Chen , Aihui Zhou

In this work, we consider a rational approximation of the exponential function to design an algorithm for computing matrix exponential in the Hermitian case. Using partial fraction decomposition, we obtain a parallelizable method, where the…

Distributed, Parallel, and Cluster Computing · Computer Science 2023-06-30 Frédéric Hecht , Sidi-Mahmoud Kaber , Lucas Perrin , Alain Plagne , Julien Salomon

In this work we discuss the possibility to reduce the computational complexity of modal methods, i.e. methods based on eigenmodes expansion, from the third power to the second power of the number of eigenmodes. The proposed approach is…

Computational Physics · Physics 2016-05-04 Igor Semenikhin , Mauro Zanuccoli

We consider an approximate computation of several minimal eigenpairs of large Hermitian matrices which come from high--dimensional problems. We use the tensor train format (TT) for vectors and matrices to overcome the curse of…

Numerical Analysis · Mathematics 2014-03-05 Sergey V. Dolgov , Boris N. Khoromskij , Ivan V. Oseledets , Dmitry V. Savostyanov

In this paper, we aim to accelerate a preconditioned alternating direction method of multipliers (pADMM), whose proximal terms are convex quadratic functions, for solving linearly constrained convex optimization problems. To achieve this,…

Optimization and Control · Mathematics 2024-12-10 Defeng Sun , Yancheng Yuan , Guojun Zhang , Xinyuan Zhao

For compact self-adjoint operators in Hilbert spaces, two algorithms are proposed to provide fully computable a posteriori error estimate for eigenfunction approximation. Both algorithms apply well to the case of tight clusters and multiple…

Numerical Analysis · Mathematics 2022-07-19 Xuefeng Liu , Tomáš Vejchodský

In this paper, we propose a two-level block preconditioned Jacobi-Davidson (BPJD) method for efficiently solving discrete eigenvalue problems resulting from finite element approximations of $2m$th ($m = 1, 2$) order symmetric elliptic…

Numerical Analysis · Mathematics 2023-04-13 Qigang Liang , Wei Wang , Xuejun Xu

Many problems in machine learning and statistics can be formulated as (generalized) eigenproblems. In terms of the associated optimization problem, computing linear eigenvectors amounts to finding critical points of a quadratic function…

Machine Learning · Computer Science 2015-03-17 Matthias Hein , Thomas Bühler

We describe preconditioned iterative methods for estimating the number of eigenvalues of a Hermitian matrix within a given interval. Such estimation is useful in a number of applications.In particular, it can be used to develop an efficient…

Numerical Analysis · Mathematics 2016-02-09 Eugene Vecharynski , Chao Yang