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A deflated restarted Lanczos algorithm is given for both solving symmetric linear equations and computing eigenvalues and eigenvectors. The restarting limits the storage so that finding eigenvectors is practical. Meanwhile, the deflating…

Mathematical Physics · Physics 2014-08-27 Abdou M. Abdel-Rehim , Ronald B. Morgan , Dywayne A. Nicely , Walter Wilcox

We present a numerical algorithm for evaluating the Boltzmann collision operator with $O(N^2)$ operations based on high order discontinuous Galerkin discretizations in the velocity variable. To formulate the approach, Galerkin projection of…

Numerical Analysis · Mathematics 2018-01-19 Alexander Alekseenko , Jeffrey Limbacher

We propose efficient preconditioning algorithms for an eigenvalue problem arising in quantum physics, namely the computation of a few interior eigenvalues and their associated eigenvectors for the largest sparse real and symmetric…

Numerical Analysis · Mathematics 2007-06-13 Olaf Schenk , Matthias Bollhoefer , Rudolf A. Roemer

We propose a distinct numerical approach to effectively solve the problem of partial diagonalization of the super-large-scale quantum electronic Hamiltonian matrices. The key ingredients of our scheme are the new method for arranging the…

Strongly Correlated Electrons · Physics 2015-08-21 I. V. Kashin , V. V. Mazurenko

A thick-restart Lanczos type algorithm is proposed for Hermitian $J$-symmetric matrices. Since Hermitian $J$-symmetric matrices possess doubly degenerate spectra or doubly multiple eigenvalues with a simple relation between the degenerate…

Numerical Analysis · Mathematics 2020-09-14 Ken-Ichi Ishikawa , Tomohiro Sogabe

The center of mass motion of trapped ions and neutral atoms is suitable for approximation by a time-dependent driven quantum harmonic oscillator whose frequency and driving strength may be controlled with high precision. We show the time…

Quantum Physics · Physics 2024-03-25 E. García Herrera , F. Torres-Leal , B. M. Rodríguez-Lara

The past thirteen years have seen the development of many algorithms for approximating matrix functions in O(N) time, where N is the basis size. These O(N) algorithms rely on assumptions about the spatial locality of the matrix function;…

Disordered Systems and Neural Networks · Physics 2011-11-09 Vincent E. Sacksteder

Designing quantum algorithms for simulating quantum systems has seen enormous progress, yet few studies have been done to develop quantum algorithms for open quantum dynamics despite its importance in modeling the system-environment…

Quantum Physics · Physics 2022-02-11 Zixuan Hu , Rongxin Xia , Sabre Kais

We describe a multi-scale resolution approach to analyzing problems in Quantum Mechanics using Daubechies wavelet basis. The expansion of the wavefunction of the quantum system in this basis allows a natural interpretation of each basis…

Quantum Physics · Physics 2020-10-15 Pavan Chawhan , Raghunath Ratabole

Nonnegative matrix factorization (NMF) is a powerful technique for dimension reduction, extracting latent factors and learning part-based representation. For large datasets, NMF performance depends on some major issues: fast algorithms,…

Optimization and Control · Mathematics 2015-07-01 Duy-Khuong Nguyen , Tu-Bao Ho

Recently double-bracket quantum algorithms have been proposed as a way to compile circuits for approximating eigenstates. Physically, they consist of appropriately composing evolutions under an input Hamiltonian together with diagonal…

We present four quantum algorithms for solving a multidimensional drift-diffusion equation. They rely on a quantum linear system solver, a quantum Hamiltonian simulation, a quantum random walk, and the quantum Fourier transform. We compare…

Quantum Physics · Physics 2025-10-16 Ellen Devereux , Animesh Datta

We present and experimentally realize a quantum algorithm for efficiently solving the following problem: given an $N\times N$ matrix $\mathcal{M}$, an $N$-dimensional vector $\textbf{\emph{b}}$, and an initial vector $\textbf{\emph{x}}(0)$,…

Computational chemistry at the atomic level has largely branched into two major fields, one based on quantum mechanics and the other on molecular mechanics using classical force fields. Because of high computational costs, quantum…

Chemical Physics · Physics 2018-10-23 Pedro E M Lopes

In the classical transformer attention scheme, we are given three $n \times d$ size matrices $Q, K, V$ (the query, key, and value tokens), and the goal is to compute a new $n \times d$ size matrix $D^{-1} \exp(QK^\top) V$ where $D =…

Data Structures and Algorithms · Computer Science 2023-10-09 Josh Alman , Zhao Song

We present a quantum algorithm that analyzes time series data simulated by a quantum differential equation solver. The proposed algorithm is a quantum version of the dynamic mode decomposition algorithm used in diverse fields such as fluid…

Quantum Physics · Physics 2024-10-17 Yuta Mizuno , Tamiki Komatsuzaki

Solving linear systems and computing eigenvalues are two fundamental problems in linear algebra. For solving linear systems, many efficient quantum algorithms have been discovered. For computing eigenvalues, currently, we have efficient…

Quantum Physics · Physics 2020-09-22 Changpeng Shao

The quantum Fourier transform and quantum wavelet transform have been cornerstones of quantum information processing. However, for non-stationary signals and anomaly detection, the Hilbert transform can be a more powerful tool, yet no prior…

Quantum Physics · Physics 2026-01-19 Henry Zhang , Joseph Li

We show a right unitary transformation approach based on Susskind-Glogower operators that diagonalizes a generalized Dicke Hamiltonian in the field basis and delivers a tridiagonal Hamiltonian in the Dicke basis. This tridiagonal…

Quantum Physics · Physics 2013-02-15 B. M. Rodríguez-Lara , H. M. Moya-Cessa

Hamiltonian diagonalization is at the heart of understanding physical properties and practical applications of quantum systems. It is highly desired to design quantum algorithms that can speedup Hamiltonian diagonalization, especially those…

Quantum Physics · Physics 2021-07-23 Jinfeng Zeng , Chenfeng Cao , Chao Zhang , Pengxiang Xu , Bei Zeng