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Ground-state preparation for a given Hamiltonian is a common quantum-computing task of great importance and has relevant applications in quantum chemistry, computational material modeling, and combinatorial optimization. We consider an…

Quantum Physics · Physics 2022-10-18 Yu-Qin Chen , Shi-Xin Zhang , Chang-Yu Hsieh , Shengyu Zhang

The iterative quasi-particle-random-phase approximation (QRPA) method we previously developed to accurately calculate properties of individual nuclear states is extended so that it can be applied for nuclei with odd numbers of neutrons and…

Nuclear Theory · Physics 2014-06-03 B. G. Carlsson , J. Toivanen

We present a stochastic variance-reduced heavy ball power iteration algorithm for solving PCA and provide a convergence analysis for it. The algorithm is an extension of heavy ball power iteration, incorporating a step size so that progress…

Optimization and Control · Mathematics 2019-01-25 Cheolmin Kim , Diego Klabjan

We present a scheme to perform an iterative variational optimization with infinite projected entangled-pair states (iPEPS), a tensor network ansatz for a two-dimensional wave function in the thermodynamic limit, to compute the ground state…

Strongly Correlated Electrons · Physics 2017-05-02 Philippe Corboz

We apply a recently developed stochastic method to the Shastry-Sutherland model on 4x4 and 8x8 lattices. This method, which we call the Stochastic State Selection Method here, enables us to evaluate expectation values of powers of the…

Statistical Mechanics · Physics 2009-11-10 Tomo Munehisa , Yasuko Munehisa

The Method of Alternating Projections (MAP), a classical algorithm for solving feasibility prob- lems, has recently been intensely studied for nonconvex sets. However, intrinsically available are only local convergence results: convergence…

Optimization and Control · Mathematics 2013-05-21 Heinz H. Bauschke , Hung M. Phan , Xianfu Wang

We present a generalization of the variational principle that is compatible with any Hamiltonian eigenstate that can be specified uniquely by a list of properties. This variational principle appears to be compatible with a wide range of…

Chemical Physics · Physics 2020-02-07 Jacqueline A. R. Shea , Elise Gwin , Eric Neuscamman

The prediction of electronic structure for strongly correlated molecules represents a promising application for near-term quantum computers. Significant attention has been paid to ground state wavefunctions, but excited states of molecules…

Quantum Physics · Physics 2025-01-08 Harper R. Grimsley , Francesco A. Evangelista

Data assimilation refers to a set of algorithms designed to compute the optimal estimate of a system's state by refining the prior prediction (known as background states) using observed data. Variational assimilation methods rely on the…

Machine Learning · Computer Science 2024-05-24 Yi Xiao , Qilong Jia , Wei Xue , Lei Bai

Classical algorithms for predicting the equilibrium geometry of strongly correlated molecules require expensive wave function methods that become impractical already for few-atom systems. In this work, we introduce a variational quantum…

We propose a quantum algorithm, inspired by ADAPT-VQE, to variationally prepare the ground state of a quantum Hamiltonian, with the desirable property that if it fails to find the ground state, it still yields a physically meaningful…

Quantum Physics · Physics 2025-05-16 Shuchen Zhu , Yu Tong

Variational algorithms for strongly correlated chemical and materials systems are one of the most promising applications of near-term quantum computers. We present an extension to the variational quantum eigensolver that approximates the…

Quantum Physics · Physics 2020-08-26 William J. Huggins , Joonho Lee , Unpil Baek , Bryan O'Gorman , K. Birgitta Whaley

We present a new method to perform variation after projection in many-body systems on quantum computers that does not require performing explicit projection. The technique employs the notion of ``oracle'', generally used in quantum search…

Quantum Physics · Physics 2022-10-21 Edgar Andres Ruiz Guzman , Denis Lacroix

Quantum state tomography is an integral part of quantum computation and offers the starting point for the validation of various quantum devices. One of the central tasks in the field of state tomography is to reconstruct with high fidelity,…

Quantum Physics · Physics 2022-12-21 Rishabh Gupta , Manas Sajjan , Raphael D. Levine , Sabre Kais

Approximate Message Passing (AMP), originally designed to solve high-dimensional linear inverse problems, has found broad applications in signal processing and statistical inference. Among its key variants, Vector Approximate Message…

Information Theory · Computer Science 2024-10-29 Qun Chen , Haochuan Zhang , Huimin Zhu

Transition amplitudes and transition probabilities are relevant to many areas of physics simulation, including the calculation of response properties and correlation functions. These quantities can also be related to solving linear systems…

Quantum Physics · Physics 2023-09-18 Nicolas PD Sawaya , Joonsuk Huh

Quantum computing methods for excited-state calculations remain underexplored in Noisy Intermediate-Scale Quantum (NISQ) hardware, despite their critical role in photochemistry and material science. Herein, we propose a resource-efficient…

Quantum Physics · Physics 2025-06-16 Qianjun Yao , He Li

We study a hardware-efficient variational quantum algorithm ansatz tailored for the trapped-ion quantum simulator, HEA-TI. We leverage programmable single-qubit rotations and global spin-spin interactions among all ions, reducing the…

Quantum Physics · Physics 2024-07-04 J. -Z. Zhuang , Y. -K. Wu , L. -M. Duan

The shortest vector problem (SVP) is one of the lattice problems and is mathematical basis for the lattice-based cryptography, which is expected to be post-quantum cryptography. The SVP can be mapped onto the Ising problem, which in…

Quantum Physics · Physics 2023-03-22 Katsuki Ura , Takashi Imoto , Tetsuro Nikuni , Shiro Kawabata , Yuichiro Matsuzaki

Random Phase Approximation (RPA) is the basic method for calculation of excited states of nuclei over the Hartree-Fock ground state, suitable also for energy density functionals (EDF or DFT). We developed a convenient formalism for…

Nuclear Theory · Physics 2025-06-19 Anton Repko , Jan Kvasil , V. O. Nesterenko , P. -G. Reinhard