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Considering recent advancements and successes in the development of efficient quantum algorithms for electronic structure calculations --- alongside impressive results using machine learning techniques for computation --- hybridizing…

Quantum Physics · Physics 2018-10-24 Rongxin Xia , Sabre Kais

Many quantum algorithms for ground-state preparation and energy estimation require the implementation of high-degree polynomials of a Hamiltonian to achieve better convergence rates. Their circuit implementation typically relies on quantum…

Quantum Physics · Physics 2025-12-25 Youngjun Park , Minhyeok Kang , Chae-Yeun Park , Joonsuk Huh

The Green's function plays a crucial role when studying the nature of quantum many-body systems, especially strongly-correlated systems. Although the development of quantum computers in the near future may enable us to compute energy…

Quantum Physics · Physics 2020-08-25 Suguru Endo , Iori Kurata , Yuya O. Nakagawa

We propose a method for constructing $\texttt{PREPARE}$ circuits for quantum phase estimation of a molecular Hamiltonian in quantum chemistry by using variational optimization of quantum circuits solely on classical computers. The…

Quantum Physics · Physics 2025-05-02 Hayata Morisaki , Kosuke Mitarai , Keisuke Fujii , Yuya O. Nakagawa

Quantum state preparation is a central primitive in many quantum algorithms, yet it is generally resource intensive, with efficient constructions known only for structured families of states. This work introduces a method for preparing…

Quantum Physics · Physics 2026-03-26 Baptiste Claudon , Alexis Lucas , Jean-Philip Piquemal , César Feniou , Julien Zylberman

We propose a variational quantum algorithm to prepare ground states of 1D lattice quantum Hamiltonians specifically tailored for programmable quantum devices where interactions among qubits are mediated by Quantum Data Buses (QDB). For…

Quantum Physics · Physics 2020-07-07 Viacheslav V. Kuzmin , Pietro Silvi

State preparation is a process encoding the classical data into the quantum systems. Based on quantum phase estimation, we propose the specific quantum circuits for a deterministic state preparation algorithm and a probabilistic state…

Quantum Physics · Physics 2019-12-12 Jian Zhao , Yu-Chun Wu , Guang-Can Guo , Guo-Ping Guo

Recently, feedback-based quantum algorithms have been introduced to calculate the ground states of Hamiltonians, inspired by quantum Lyapunov control theory. This paper aims to generalize these algorithms to the problem of calculating an…

Quantum Physics · Physics 2026-01-21 Salahuddin Abdul Rahman , Özkan Karabacak , Rafal Wisniewski

We propose a quantum inverse iteration algorithm which can be used to estimate the ground state properties of a programmable quantum device. The method relies on the inverse power iteration technique, where the sequential application of the…

Quantum Physics · Physics 2020-01-22 Oleksandr Kyriienko

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

In this work, we present a quantum algorithm for ground-state energy calculations of periodic solids on error-corrected quantum computers. The algorithm is based on the sparse qubitization approach in second quantization and developed for…

Quantum computing is believed to be particularly useful for the simulation of chemistry and materials, among the various applications. In recent years, there have been significant advancements in the development of near-term quantum…

Quantum Physics · Physics 2022-10-12 Guoming Wang , Sukin Sim , Peter D. Johnson

We introduce a quantum algorithm to efficiently prepare states with a small energy variance at the target energy. We achieve it by filtering a product state at the given energy with a Lorentzian filter of width $\delta$. Given a local…

Quantum Physics · Physics 2024-07-03 Reinis Irmejs , Mari Carmen Bañuls , J. Ignacio Cirac

Most quantum algorithms designed to generate or probe properties of the ground state of a quantum many-body system require as input an initial state with a large overlap with the desired ground state. One approach for preparing such a…

Quantum state preparation is an important class of quantum algorithms that is employed as a black-box subroutine in many algorithms, or used by itself to generate arbitrary probability distributions. We present a novel state preparation…

Quantum Physics · Physics 2020-06-02 Yutaro Iiyama

Answering whether quantum computers can efficiently simulate quantum field theories has both theoretical and practical motivation. From the theoretical point of view, it answers the question of whether a hypothetical computer that utilizes…

Quantum Physics · Physics 2019-11-12 Ali Hamed Moosavian , James R. Garrison , Stephen P. Jordan

We present an efficient quantum algorithm for preparing a pure state on a quantum computer, where the quantum state corresponds to that of a molecular system with a given number $m$ of electrons occupying a given number $n$ of spin…

Quantum Physics · Physics 2009-05-01 Hefeng Wang , S. Ashhab , Franco Nori

We explore a non-variational quantum state preparation approach combined with the ADAPT operator selection strategy in the application of preparing the ground state of a desired target Hamiltonian. In this algorithm, energy gradient…

A new method is proposed for determining the ground state wave function of a quantum many-body system on a quantum computer, without requiring an initial trial wave function that has good overlap with the true ground state. The technique of…

Quantum Physics · Physics 2017-09-26 David B. Kaplan , Natalie Klco , Alessandro Roggero

Ground state preparation is a central application for quantum computers but remains challenging in practice. In this work, we quantitatively investigate the performance and gate counts of double-bracket quantum algorithms (DBQAs) for ground…