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This work concerns the global minimization of a prescribed eigenvalue or a weighted sum of prescribed eigenvalues of a Hermitian matrix-valued function depending on its parameters analytically in a box. We describe how the analytical…

Numerical Analysis · Mathematics 2016-05-11 Emre Mengi , Emre Alper Yildirim , Mustafa Kilic

In electronic structure calculations, the transcorrelated method consists in transforming the Hamiltonian so as to remove the Coulomb cusp in its eigenfunctions. As a result, the wavefunction can be described more accurately without…

Quantum Physics · Physics 2026-04-14 Alexey Uvarov , Artur F. Izmaylov

The motivation for studying non-Hermitian systems and the role of $\mathcal{PT}$-symmetry is discussed. We investigate the use of a quantum algorithm to find the eigenvalues and eigenvectors of non-Hermitian Hamiltonians, with applications…

Quantum Physics · Physics 2025-01-29 James Hancock , Matthew J. Craven , Craig McNeile , Davide Vadacchino

A common challenge faced in quantum physics is finding the extremal eigenvalues and eigenvectors of a Hamiltonian matrix in a vector space so large that linear algebra operations on general vectors are not possible. There are numerous…

Nuclear Theory · Physics 2018-07-18 Dillon Frame , Rongzheng He , Ilse Ipsen , Daniel Lee , Dean Lee , Ermal Rrapaj

Quantum phase estimation is one of the most powerful quantum primitives. This work proposes a new approach for the problem of multiple eigenvalue estimation: Quantum Multiple Eigenvalue Gaussian filtered Search (QMEGS). QMEGS leverages the…

Quantum Physics · Physics 2024-10-02 Zhiyan Ding , Haoya Li , Lin Lin , HongKang Ni , Lexing Ying , Ruizhe Zhang

Unlike well-established parameter estimation, function estimation faces conceptual and mathematical difficulties despite its enormous potential utility. We establish the fundamental error bounds on function estimation in quantum metrology…

Quantum Physics · Physics 2020-01-29 Naoto Kura , Masahito Ueda

We construct a quantum-inspired classical algorithm for computing the permanent of Hermitian positive semidefinite matrices, by exploiting a connection between these mathematical structures and the boson sampling model. Specifically, the…

Quantum Physics · Physics 2017-09-01 L. Chakhmakhchyan , N. J. Cerf , R. Garcia-Patron

We propose a novel framework for the quantum geometry of expectation values over arbitrary sets of operators and establish a link between this geometry and the eigenstates of Hamiltonian families generated by these operators. We show that…

Quantum Physics · Physics 2023-06-21 Chaoming Song

A numerical algorithm is proposed to deal with parametric eigenvalue problems involving non-Hermitian matrices and is exploited to find location of defective eigenvalues in the parameter space of non-Hermitian parametric eigenvalue…

Computational Physics · Physics 2026-01-23 Benoit Nennig , Martin Ghienne , Emmanuel Perrey-Debain

We propose a natural application of Quantum Linear Systems Problem (QLSP) solvers such as the HHL algorithm to efficiently prepare highly excited interior eigenstates of physical Hamiltonians in a variational and targeted manner. This is…

Quantum Physics · Physics 2023-10-13 Shao-Hen Chiew , Leong-Chuan Kwek

Quantum algorithms speeding up classical counterparts are proposed for the problems: 1. Recognition of eigenvalues with fixed precision. Given a quantum circuit generating unitary mapping $U$ and a complex number the problem is to determine…

Quantum Physics · Physics 2007-05-23 Yuri I. Ozhigov

Quantum physics is generally concerned with real eigenvalues due to the unitarity of time evolution. With the introduction of $\mathcal{PT}$ symmetry, a widely accepted consensus is that, even if the Hamiltonian of the system is not…

Quantum Physics · Physics 2023-09-19 Tong Liu , Youguo Wang

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

Intertwining analysis, algebra, numerical analysis and optimization, computing conjugate co-gradients of real-valued quotients gives rise to eigenvalue problems. In the linear Hermitian case, by inspecting optimal quotients in terms of…

Spectral Theory · Mathematics 2022-11-14 Marko Huhtanen , Olavi Nevanlinna

Finding a good approximation of the top eigenvector of a given $d\times d$ matrix $A$ is a basic and important computational problem, with many applications. We give two different quantum algorithms that, given query access to the entries…

Quantum Physics · Physics 2024-11-15 Yanlin Chen , András Gilyén , Ronald de Wolf

Time symmetry in quantum mechanics, where the current quantum state is determined jointly by both the past and the future, offers a more comprehensive description of physical phenomena. This symmetry facilitates both forward and backward…

Quantum Physics · Physics 2025-06-13 Shijie Wei , Jingwei Wen , Xiaogang Li , Peijie Chang , Bozhi Wang , Franco Nori , Guilu Long

The rapid advancements in quantum computing (QC) and machine learning (ML) have sparked significant interest, driving extensive exploration of quantum machine learning (QML) algorithms to address a wide range of complex challenges. The…

Quantum Physics · Physics 2025-05-27 Samuel Yen-Chi Chen , Huan-Hsin Tseng , Hsin-Yi Lin , Shinjae Yoo

Describing the evolution of quantum systems by means of non-Hermitian generators opens a new avenue to explore the dynamical properties naturally emerging in such a picture, e.g. operation at the so-called exceptional points, preservation…

Quantum Physics · Physics 2023-12-01 Javid Naikoo , Ravindra W. Chhajlany , Jan Kolodynski

Solving non-Hermitian quantum many-body systems on a quantum computer by minimizing the variational energy is challenging as the energy can be complex. Here, based on energy variance, we propose a variational method for solving the…

Quantum Physics · Physics 2024-02-21 Xu-Dan Xie , Zheng-Yuan Xue , Dan-Bo Zhang

Identifying unknown Hamiltonians from their quantum dynamics is a pivotal challenge in quantum technologies. In this paper, we introduce Hamiltonian recognition, a framework that bridges quantum hypothesis testing and quantum metrology,…

Quantum Physics · Physics 2026-02-26 Chengkai Zhu , Shuyu He , Yu-Ao Chen , Lei Zhang , Xin Wang