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Quantum algorithms for electronic-structure simulations are actively being developed, yet many hybrid quantum-classical approaches are bottlenecked by the measurement overhead associated with large molecular Hamiltonians. Here we introduce…

Quantum Physics · Physics 2026-03-10 Benjamin Mokhtar , Noboru Inoue , Takashi Tsuchimochi

We propose two different strategies to find eigenvalues and eigenvectors of a given, not necessarily Hermitian, matrix $A$. Our methods apply also to the case of complex eigenvalues, making the strategies interesting for applications to…

Mathematical Physics · Physics 2020-06-24 Fabio Bagarello , Francesco Gargano

Developing efficient quantum computing algorithms is essential for tackling computationally challenging problems across various fields. This paper presents a novel quantum algorithm, XZ24, for efficiently computing the eigen-energy spectra…

Quantum Physics · Physics 2024-09-30 Qing-Xing Xie , Yan Zhao

By exploiting the connection between solving algebraic $\top$-Riccati equations and computing certain deflating subspaces of $\top$-palindromic matrix pencils, we obtain theoretical and computational results on both problems. Theoretically,…

Numerical Analysis · Mathematics 2023-02-22 Bruno Iannazzo , Beatrice Meini , Federico Poloni

In recent years, a new kind of accelerated hardware has gained popularity in the Artificial Intelligence (AI) and Machine Learning (ML) communities which enables extremely high-performance tensor contractions in reduced precision for deep…

Computational Physics · Physics 2024-05-01 Adela Habib , Joshua Finkelstein , Anders M. N. Niklasson

We develop an efficient algorithm for sampling the eigenvalues of random matrices distributed according to the Haar measure over the orthogonal or unitary group. Our technique samples directly a factorization of the Hessenberg form of such…

Numerical Analysis · Mathematics 2021-02-25 Massimiliano Fasi , Leonardo Robol

Quantum algorithms for diverse problems, including search and optimization problems, require the implementation of a reflection operator over a target state. Commonly, such reflections are approximately implemented using phase estimation.…

Quantum Physics · Physics 2018-03-08 Anirban Narayan Chowdhury , Yigit Subasi , Rolando D. Somma

We develop an iterative refinement method that improves the accuracy of a user-chosen subset of $k$ eigenvectors ($k\ll n$) of an $n\times n$ real symmetric matrix. Using an orthogonal matrix represented in compact WY form, the method…

Numerical Analysis · Mathematics 2026-03-02 Takeshi Terao , Katsuhisa Ozaki , Toshiyuki Imamura , Takeshi Ogita

In this work we introduce and study novel Quasi Newton minimization methods based on a Hessian approximation Broyden Class-\textit{type} updating scheme, where a suitable matrix $\tilde{B}_k$ is updated instead of the current Hessian…

Numerical Analysis · Mathematics 2020-01-22 S. Cipolla , C. Di Fiore , P. Zellini

In this paper, we introduce novel fast matrix inversion algorithms that leverage triangular decomposition and recurrent formalism, incorporating Strassen's fast matrix multiplication. Our research places particular emphasis on triangular…

Numerical Analysis · Mathematics 2026-02-05 Mohamed Kamel Riahi

Quantum phase estimation is a cornerstone in quantum algorithm design, allowing for the inference of eigenvalues of exponentially-large sparse matrices.The maximum rate at which these eigenvalues may be learned, --known as the Heisenberg…

Quantum Physics · Physics 2022-10-12 Alicja Dutkiewicz , Barbara M. Terhal , Thomas E. O'Brien

This paper introduces a randomized Householder QR factorization (RHQR). This factorization can be used to obtain a well conditioned basis of a vector space and thus can be employed in a variety of applications. The RHQR factorization of the…

Numerical Analysis · Mathematics 2024-05-24 Laura Grigori , Edouard Timsit

Dictionary learning is the task of determining a data-dependent transform that yields a sparse representation of some observed data. The dictionary learning problem is non-convex, and usually solved via computationally complex iterative…

Machine Learning · Computer Science 2016-11-30 Cristian Rusu , Nuria Gonzalez-Prelcic , Robert Heath

Pole-swapping algorithms, which are generalizations of the QZ algorithm for the generalized eigenvalue problem, are studied. A new modular (and therefore more flexible) convergence theory that applies to all pole-swapping algorithms is…

Numerical Analysis · Mathematics 2022-05-02 Daan Camps , Thomas Mach , Raf Vandebril , David S. Watkins

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

A new method to represent and approximate rotation matrices is introduced. The method represents approximations of a rotation matrix $Q$ with linearithmic complexity, i.e. with $\frac{1}{2}n\lg(n)$ rotations over pairs of coordinates,…

Machine Learning · Computer Science 2014-04-30 Michael Mathieu , Yann LeCun

A new algorithm to compute the restricted singular value decomposition of dense matrices is presented. Like Zha's method \cite{Zha92}, the new algorithm uses an implicit Kogbetliantz iteration, but with four major innovations. The first…

Numerical Analysis · Mathematics 2020-02-13 Ian N. Zwaan

A fundamental problem when adding column pivoting to the Householder QR factorization is that only about half of the computation can be cast in terms of high performing matrix-matrix multiplications, which greatly limits the benefits that…

Numerical Analysis · Mathematics 2016-12-08 Per-Gunnar Martinsson , Gregorio Quintana-Orti , Nathan Heavner , Robert van de Geijn

We present a new framework for computing Z-eigenvectors of general tensors based on numerically integrating a dynamical system that can only converge to a Z-eigenvector. Our motivation comes from our recent research on spacey random walks,…

Numerical Analysis · Mathematics 2019-03-14 Austin R. Benson , David F. Gleich

The computation of matrix functions is a well-studied problem. Of special importance are the exponential and the logarithm of a matrix, where the latter also raises existence and uniqueness questions. This is particularly relevant in the…

Rings and Algebras · Mathematics 2024-06-17 Ellen Baake , Michael Baake