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Modeling low energy eigenstates of fermionic systems can provide insight into chemical reactions and material properties and is one of the most anticipated applications of quantum computing. We present three techniques for reducing the cost…

Processes related to electronically excited states are central in many areas of science, however accurately determining excited-state energies remains a major challenge in theoretical chemistry. Recently, higher energy stationary states of…

Chemical Physics · Physics 2020-06-05 Hugh G. A. Burton , Alex J. W. Thom , Pierre-François Loos

We analyze a technique for the preparation of low entropy many body states of atoms in optical lattices based on adiabatic passage. In particular, we show that this method allows preparation of strongly correlated states as stable highest…

Simulating many-body systems is one of the most promising applications of near-term quantum computers. An important open question is how to efficiently prepare the ground states of arbitrary fermionic Hamiltonians, especially those with…

Strongly Correlated Electrons · Physics 2025-04-01 Gilad Kishony , Mark S. Rudner , Erez Berg

Quantum computers attract much attention as they promise to outperform their classical counterparts in solving certain type of problems. One of them with practical applications in quantum chemistry is simulation of complex quantum systems.…

Quantum Physics · Physics 2014-07-08 Libor Veis , Jiří Pittner

The preparation of quantum states using short quantum circuits is one of the most promising near-term applications of small quantum computers, especially if the circuit is short enough and the fidelity of gates high enough that it can be…

Quantum Physics · Physics 2015-10-07 D. Wecker , M. B. Hastings , M. Troyer

Electronic excited states are central to a vast array of physical and chemical phenomena, yet accurate and efficient methods for preparing them on quantum devices remain challenging and comparatively underexplored. We introduce a general…

Quantum Physics · Physics 2026-02-02 Hao-En Li , Lin Lin

We discuss how an $\eta$-condensate, corresponding to an exact excited eigenstate of the Fermi-Hubbard model, can be produced with cold atoms in an optical lattice. Using time-dependent density matrix renormalisation group methods, we…

Quantum Gases · Physics 2012-09-12 A. Kantian A. J. Daley P. Zoller

A variety of quantum computing algorithms exist for the preparation of approximate Hamiltonian ground states. A natural and important question is how these ground-state approximations can be further improved using adiabatic state…

Quantum state preparation lies at the heart of quantum computation and quantum simulations, enabling the investigation of complex manybody systems across physics, chemistry, and data science. While existing methods such as Variational…

Quantum Physics · Physics 2026-01-27 Davide Cugini , Giacomo Guarnieri , Mario Motta , Dario Gerace

Quantum Mechanical ground states of many-body systems can be important resources for various investigations: for quantum sensing, as the initial state for nonequilibrium quantum dynamics following quenches, and the simulation of quantum…

Quantum Physics · Physics 2025-11-18 Prashasti Tiwari , Dylan Lewis , Sougato Bose

Within the present noisy intermediate-scale quantum-computing era, hybrid quantum-classical-processor algorithms have emerged as promising avenues for tackling electronic-structure eigenproblems. Among them, the so-called…

Quantum Physics · Physics 2026-05-21 Christophe Soule , Bruno Senjean , Benjamin Lasorne

Quantum annealing (QA) is one of the ways to search the ground state of the problem Hamiltonian. Here, we propose the QA scheme to search arbitrary excited states of the problem Hamiltonian. In our scheme, an $n$-th excited state of the…

Quantum Physics · Physics 2021-04-21 Yuya Seki , Yuichiro Matsuzaki , Shiro Kawabata

A method is presented in which the ground-state subspace is projected out of a Hamiltonian representation. As a result of this projection, an effective Hamiltonian is constructed where its ground-state coincides with an excited-state of the…

Quantum Physics · Physics 2023-08-14 P. Jouzdani , S. Bringuier , M. Kostuk

Quantum annealing is a way to prepare an eigenstate of the problem Hamiltonian. Starting from an eigenstate of a trivial Hamiltonian, we slowly change the Hamiltonian to the problem Hamiltonian, and the system remains in the eigenstate of…

Quantum Physics · Physics 2023-05-26 Takashi Imoto , Yuki Susa , Ryoji Miyazaki , Tadashi Kadowaki , Yuichiro Matsuzaki

Excited states of molecules lie in the heart of photochemistry and chemical reactions. The recent development in quantum computational chemistry leads to inventions of a variety of algorithms that calculate the excited states of molecules…

Quantum Physics · Physics 2020-11-05 Hiroki Kawai , Yuya O. Nakagawa

Many physically interesting models show a quantum phase transition when a single parameter is varied through a critical point, where the ground state and the first excited state become degenerate. When this parameter appears as a coupling…

Quantum Physics · Physics 2008-09-24 Gernot Schaller

We propose applying the adiabatic algorithm to prepare high-energy eigenstates of integrable models on a quantum computer. We first review the standard adiabatic algorithm to prepare ground states in each magnetization sector of the…

Quantum Physics · Physics 2026-03-18 Maximilian Lutz , Lorenzo Piroli , Georgios Styliaris , J. Ignacio Cirac

The computation of excited electronic states is an important application for quantum computers. In this work, we simulate the excited state spectra of four aromatic heterocycles on IBM superconducting quantum computers, focusing on active…

Quantum Physics · Physics 2023-09-19 Maria A. Castellanos , Mario Motta , Julia E. Rice

The calculation of excited state energies of electronic structure Hamiltonians has many important applications, such as the calculation of optical spectra and reaction rates. While low-depth quantum algorithms, such as the variational…

Quantum Physics · Physics 2019-07-03 Oscar Higgott , Daochen Wang , Stephen Brierley
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