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We present a computationally efficient approach to solve the time-dependent Kohn-Sham equations in real-time using higher-order finite-element spatial discretization, applicable to both pseudopotential and all-electron calculations. To this…

Computational Physics · Physics 2019-10-02 Bikash Kanungo , Vikram Gavini

This work explores the representation of univariate and multivariate functions as matrix product states (MPS), also known as quantized tensor-trains (QTT). It proposes an algorithm that employs iterative Chebyshev expansions and Clenshaw…

A novel method which is called the Chebyshev inertial iteration for accelerating the convergence speed of fixed-point iterations is presented. The Chebyshev inertial iteration can be regarded as a valiant of the successive over relaxation…

Optimization and Control · Mathematics 2021-06-09 Tadashi Wadayama , Satoshi Takabe

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

We propose a new method for identifying and estimating the CP-factor models for matrix time series. Unlike the generalized eigenanalysis-based method of Chang et al. (2023) for which the convergence rates of the associated estimators may…

Methodology · Statistics 2025-07-29 Jinyuan Chang , Yue Du , Guanglin Huang , Qiwei Yao

We propose iterative projection methods for solving square or rectangular consistent linear systems Ax = b. Existing projection methods use sketching matrices (possibly randomized) to generate a sequence of small projected subproblems, but…

Numerical Analysis · Mathematics 2023-12-13 Johannes J. Brust , Michael A. Saunders

The class of quasiseparable matrices is defined by the property that any submatrix entirely below or above the main diagonal has small rank, namely below a bound called the order of quasiseparability. These matrices arise naturally in…

Symbolic Computation · Computer Science 2019-10-22 Clement Pernet , Arne Storjohann

This paper proposes a semidefinite programming based method for estimating moments of a stochastic hybrid system (SHS). For polynomial SHSs -- which consist of polynomial continuous vector fields, reset maps, and transition intensities --…

Optimization and Control · Mathematics 2018-02-02 Khem Raj Ghusinga , Andrew Lamperski , Abhyudai Singh

The Douglas-Rachford (DR) method is a widely used method for finding a point in the intersection of two closed convex sets (feasibility problem). However, the method converges weakly and the associated rate of convergence is hard to analyze…

Optimization and Control · Mathematics 2024-01-10 Deren Han , Yansheng Su , Jiaxin Xie

This paper considers computing interior singular triplets corresponding to the singular values in some interval. Based on the concept of the complex moment-based parallel eigensolvers, in this paper, we propose a novel complex moment-based…

Numerical Analysis · Mathematics 2021-09-29 Akira Imakura , Tetsuya Sakurai

Recently, a kind of eigensolvers based on contour integral were developed for computing the eigenvalues inside a given region in the complex plane. The CIRR method is a classic example among this kind of methods. In this paper, we propose a…

Numerical Analysis · Mathematics 2015-08-19 Guojian Yin

This article is concerned with an extension of univariate Chebyshev polynomials of the first kind to the multivariate setting, where one chases best approximants to specific monomials by polynomials of lower degree relative to the uniform…

Optimization and Control · Mathematics 2024-10-29 Mareike Dressler , Simon Foucart , Mioara Joldes , Etienne de Klerk , Jean Bernard Lasserre , Yuan Xu

For a symmetric positive semidefinite linear system of equations $\mathcal{Q} {\bf x} = {\bf b}$, where ${\bf x} = (x_1,\ldots,x_s)$ is partitioned into $s$ blocks, with $s \geq 2$, we show that each cycle of the classical block symmetric…

Numerical Analysis · Mathematics 2017-05-24 Xudong Li , Defeng Sun , Kim-Chuan Toh

Multipoint polynomial evaluation and interpolation are fundamental for modern symbolic and numerical computing. The known algorithms solve both problems over any field of constants in nearly linear arithmetic time, but the cost grows to…

Numerical Analysis · Mathematics 2017-04-19 Victor Y. Pan

This paper studies quasi-Newton methods for solving strongly-convex-strongly-concave saddle point problems (SPP). We propose greedy and random Broyden family updates for SPP, which have explicit local superlinear convergence rate of…

Optimization and Control · Mathematics 2022-04-12 Chengchang Liu , Luo Luo

We develop a new parallel algorithm for minimizing Lipschitz, convex functions with a stochastic subgradient oracle. The total number of queries made and the query depth, i.e., the number of parallel rounds of queries, match the prior…

Optimization and Control · Mathematics 2024-06-12 Arun Jambulapati , Aaron Sidford , Kevin Tian

Exponential divided differences arise in numerical linear algebra, matrix-function evaluation, and quantum Monte Carlo simulations, where they serve as kernel weights for time evolution and observable estimation. Efficient and numerically…

Computational Physics · Physics 2025-12-30 Itay Hen

We propose a novel block-row partitioning method in order to improve the convergence rate of the block Cimmino algorithm for solving general sparse linear systems of equations. The convergence rate of the block Cimmino algorithm depends on…

Numerical Analysis · Computer Science 2018-12-27 F. Sukru Torun , Murat Manguoglu , Cevdet Aykanat

In this paper, we derive a randomized version of the Mirror-Prox method for solving some structured matrix saddle-point problems, such as the maximal eigenvalue minimization problem. Deterministic first-order schemes, such as Nesterov's…

Optimization and Control · Mathematics 2011-12-07 Michel Baes , Michael Bürgisser , Arkadi Nemirovski

We revisit a classical problem in numerical linear algebra: given an $k$-dimensional subspace $\mathcal{Q}$ that approximates the leading eigenspace of an $n\times n$ positive semi-definite matrix $A$, the goal is to extract high-accuracy…

Numerical Analysis · Mathematics 2026-05-07 Yuji Nakatsukasa , Zheng Tang