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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

It is well known that the usual mixed method for solving the biharmonic eigenvalue problem by decomposing the operator into two Laplacians may generate spurious eigenvalues on non-convex domains. To overcome this difficulty, we adopt a…

Numerical Analysis · Mathematics 2021-07-27 Baiju Zhang , Hengguang Li , Zhimin Zhang

Optimization of convex functions subject to eigenvalue constraints is intriguing because of peculiar analytical properties of eigenvalues, and is of practical interest because of wide range of applications in fields such as structural…

Numerical Analysis · Mathematics 2013-10-08 Emre Mengi

A new iterative method for solving large scale symmetric nonlinear eigenvalue problems is presented. We firstly derive an infinite dimensional symmetric linearization of the nonlinear eigenvalue problem, then we apply the indefinite Lanczos…

Numerical Analysis · Mathematics 2019-10-11 Giampaolo Mele

Eigenvalue transformations, which include solving time-dependent differential equations as a special case, have a wide range of applications in scientific and engineering computation. While quantum algorithms for singular value…

Quantum Physics · Physics 2024-11-07 Dong An , Andrew M. Childs , Lin Lin , Lexing Ying

Efficient solution of the lowest eigenmodes is studied for a family of related eigenvalue problems with common $2\times 2$ block structure. It is assumed that the upper diagonal block varies between different versions while the lower…

Numerical Analysis · Mathematics 2020-06-19 Antti Hannukainen , Jarmo Malinen , Antti Ojalammi

We calculate eigenvalues of one-dimensional quantum-systems by the exact numerical solution of the Lippmann-Schwinger equation, analogous to the scattering problem. To illustrate our method, we treat elementary problems: the harmonic and…

Quantum Physics · Physics 2019-12-04 Alexander Jurisch

We present a new numerical technique to solve large-scale eigenvalue problems. It is based on the projection technique, used in strongly correlated quantum many-body systems, where first an effective approximate model of smaller complexity…

Strongly Correlated Electrons · Physics 2015-05-19 Ralf Gamillscheg , Gundolf Haase , Wolfgang von der Linden

SLEPc is a parallel library for the solution of various types of large-scale eigenvalue problems. In the last years we have been developing a module within SLEPc, called NEP, that is intended for solving nonlinear eigenvalue problems. These…

Mathematical Software · Computer Science 2021-06-29 Carmen Campos , Jose E. Roman

We consider the Bethe Salpeter approach to the BFKL evolution in order to naturally incorporate the property of the Hermitian Separability in the BFKL approach. We combine the resulting all order ansatz for the BFKL eigenvalue together with…

High Energy Physics - Theory · Physics 2021-02-03 Mohammad Joubat , Alex Prygarin

The Bethe-Salpeter equation for bound states of a fermion-antifermion pair in the instantaneous approximation for the involved interaction kernel is converted into an equivalent matrix eigenvalue problem with explicitly (algebraically)…

High Energy Physics - Phenomenology · Physics 2007-05-23 Wolfgang Lucha , Khin Maung Maung , F. F. Schoberl

Estimating the eigenvalues of non-normal matrices is a foundational problem with far-reaching implications, from modeling non-Hermitian quantum systems to analyzing complex fluid dynamics. Yet, this task remains beyond the reach of standard…

Quantum Physics · Physics 2025-10-23 Yukun Zhang , Yusen Wu , Xiao Yuan

This paper introduces a novel neural network for efficiently solving Structured Inverse Eigenvalue Problems (SIEPs). The main contributions lie in two aspects: firstly, a unified framework is proposed that can handle various SIEPs…

Numerical Analysis · Mathematics 2024-07-01 Shuai Zhang , Xuelian Jiang , Hao Qian , Yingxiang Xu

We consider the minimization or maximization of the $J$th largest eigenvalue of an analytic and Hermitian matrix-valued function, and build on Mengi et al. (2014, SIAM J. Matrix Anal. Appl., 35, 699-724). This work addresses the setting…

Numerical Analysis · Mathematics 2017-06-19 Fatih Kangal , Karl Meerbergen , Emre Mengi , Wim Michiels

We study the eigenvalue problem for some special class of anti-triangular matrices. Though the eigenvalue problem is quite classical, as far as we know, almost nothing is known about properties of eigenvalues for anti-triangular matrices.…

Rings and Algebras · Mathematics 2014-03-27 Hiroyuki Ochiai , Makiko Sasada , Tomoyuki Shirai , Takashi Tsuboi

The solution of (generalized) eigenvalue problems for symmetric or Hermitian matrices is a common subtask of many numerical calculations in electronic structure theory or materials science. Solving the eigenvalue problem can easily amount…

Mathematical Software · Computer Science 2020-01-08 P. Kus , A. Marek , S. S. Koecher , H. -H. Kowalski , C. Carbogno , Ch. Scheurer , K. Reuter , M. Scheffler , H. Lederer

A famous theorem by R. Brauer shows how to modify a single eigenvalue of a matrix by a rank-one update without changing the remaining eigenvalues. A generalization of this theorem (due to R. Rado) is used to change a pair of eigenvalues of…

Numerical Analysis · Mathematics 2023-02-01 Philip Saltenberger

We consider computing the $k$-th eigenvalue and its corresponding eigenvector of a generalized Hermitian eigenvalue problem of $n\times n$ large sparse matrices. In electronic structure calculations, several properties of materials, such as…

Numerical Analysis · Mathematics 2018-08-01 Dongjin Lee , Takeo Hoshi , Tomohiro Sogabe , Yuto Miyatake , Shao-Liang Zhang

We study two inexact methods for solutions of random eigenvalue problems in the context of spectral stochastic finite elements. In particular, given a parameter-dependent, symmetric matrix operator, the methods solve for eigenvalues and…

Numerical Analysis · Mathematics 2018-12-27 Kookjin Lee , Bedřich Sousedík

The Laplace-Beltrami operator on (the surface of) a triaxial ellipsoid admits a sequence of real eigenvalues diverging to plus infinity. By introducing ellipsoidal coordinates, this eigenvalue problem for a partial differential operator is…

Classical Analysis and ODEs · Mathematics 2024-07-29 Hans Volkmer
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