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Eigenvalue estimation is a central problem for demonstrating quantum advantage, yet its implementation on digital quantum computers remains limited by circuit depth and operational overhead. We present an analog quantum phase estimation…

Quantum Physics · Physics 2025-06-19 Wei-Chen Lin , Chiao-Hsuan Wang

Nonlinear equations are challenging to solve due to their inherently nonlinear nature. As analytical solutions typically do not exist, numerical methods have been developed to tackle their solutions. In this article, we give a quantum…

Quantum Physics · Physics 2025-11-04 Nhat A. Nghiem , Tzu-Chieh Wei

Accurately predicting response properties of molecules such as the dynamic polarizability and hyperpolarizability using quantum mechanics has been a long-standing challenge with widespread applications in material and drug design. Classical…

Chemical Physics · Physics 2020-09-01 Xiaoxia Cai , Wei-Hai Fang , Heng Fan , Zhendong Li

We present a quantum adiabatic algorithm for a set of quantum 2-satisfiability (Q2SAT) problem, which is a generalization of 2-satisfiability (2SAT) problem. For a Q2SAT problem, we construct the Hamiltonian which is similar to that of a…

Quantum Physics · Physics 2021-02-08 Yanglin Hu , Zhelun Zhang , Biao Wu

Determining ground state energies of quantum systems by hybrid classical/quantum methods has emerged as a promising candidate application for near-term quantum computational resources. Short of large-scale fault-tolerant quantum computers,…

Quantum Physics · Physics 2016-10-25 Nicholas C. Rubin

We present a complete prescription for the numerical calculation of surface Green's functions and self-energies of semi-infinite quasi-onedimensional systems. Our work extends the results of Sanvito et al. [1] generating a robust algorithm…

Materials Science · Physics 2007-12-11 Ivan Rungger , Stefano Sanvito

Nonlocal Hamiltonian-type operators, like e.g. fractional and quasirelativistic, seem to be instrumental for a conceptual broadening of current quantum paradigms. However physically relevant properties of related quantum systems have not…

Quantum Physics · Physics 2023-07-19 Piotr Garbaczewski , Mariusz Żaba

Drawing the quantum phase diagram of a many-body system in the parameter space of its Hamiltonian can be seen as a learning problem, which implies labelling the corresponding ground states according to some classification criterium that…

Quantum Physics · Physics 2025-10-17 Mehran Khosrojerdi , Alessandro Cuccoli , Paola Verrucchi , Leonardo Banchi

We describe a quantum algorithm for finding the smallest eigenvalue of a Hermitian matrix. This algorithm combines Quantum Phase Estimation and Quantum Amplitude Estimation to achieve a quadratic speedup with respect to the best classical…

We propose a novel quantum Monte Carlo method in configuration space, which stochastically samples the contribution from a large secondary space to the effective Hamiltonian in the energy dependent partitioning of L\"owdin. The method…

Chemical Physics · Physics 2015-06-15 Seiichiro Ten-no

We investigate the computational complexity of the Local Hamiltonian (LH) problem and the approximation of the Quantum Partition Function (QPF), two central problems in quantum many-body physics and quantum complexity theory. Both problems…

Quantum Physics · Physics 2025-10-10 Nai-Hui Chia , Yu-Ching Shen

The computational cost of quantum algorithms for physics and chemistry is closely linked to the spectrum of the Hamiltonian, a property that manifests in the necessary rescaling of its eigenvalues. The typical approach of using the 1-norm…

The estimation of low energies of many-body systems is a cornerstone of computational quantum sciences. Variational quantum algorithms can be used to prepare ground states on pre-fault-tolerant quantum processors, but their lack of…

Variational quantum eigensolver~(VQE) typically optimizes variational parameters in a quantum circuit to prepare eigenstates for a quantum system. Its applications to many problems may involve a group of Hamiltonians, e.g., Hamiltonian of a…

Quantum Physics · Physics 2021-01-19 Zhan-Hao Yuan , Tao Yin , Dan-Bo Zhang

A particle confined to an impassable box is a paradigmatic and exactly solvable one-dimensional quantum system modeled by an infinite square well potential. Here we explore some of its infinitely many generalizations to two dimensions,…

Computational Physics · Physics 2023-02-06 Elliott G. Holliday , John F. Lindner , William L. Ditto

We present a quantum computing formulation to address a challenging problem in the development of probabilistic learning on manifolds (PLoM). It involves solving the spectral problem of the high-dimensional Fokker-Planck (FKP) operator,…

Quantum Physics · Physics 2025-02-21 Christian Soize , Loïc Joubert-Doriol , Artur F. Izmaylov

Hamiltonian simulation is a domain where quantum computers have the potential to outperform their classical counterparts. One of the main challenges of such quantum algorithms is increasing the system size, which is necessary to achieve…

Quantum Physics · Physics 2025-02-07 Erenay Karacan , Yanbin Chen , Christian B. Mendl

We propose the notion of $E_{2}$-quasi-exact solvability and apply this idea to find explicit solutions to the eigenvalue problem for a non-Hermitian Hamiltonian system depending on two parameters. The model considered reduces to the…

Quantum Physics · Physics 2015-05-18 Andreas Fring

Quantum computers, using efficient Hamiltonian evolution routines, have the potential to simulate Green's functions of classically-intractable quantum systems. However, the decoherence errors of near-term quantum processors prohibit large…

Quantum Physics · Physics 2023-12-20 Diogo Cruz , Duarte Magano

Solving the generalized eigenvalue problem is a useful method for finding energy eigenstates of large quantum systems. It uses projection onto a set of basis states which are typically not orthogonal. One needs to invert a matrix whose…

Nuclear Theory · Physics 2023-04-05 Caleb Hicks , Dean Lee