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Monte Carlo techniques with importance sampling have been extensively applied to lattice gauge theory in the Lagrangian formulation. Unfortunately, it is extremely difficult to compute the excited states using the conventional Monte Carlo…

High Energy Physics - Lattice · Physics 2017-08-23 Xiang-Qian Luo , H. Jirari , H. Kroger , K. Moriarty

A candidate application for quantum computers is to simulate the low-temperature properties of quantum systems. For this task, there is a well-studied quantum algorithm that performs quantum phase estimation on an initial trial state that…

Quantum Physics · Physics 2024-11-04 Chi-Fang , Chen , Alexander M. Dalzell , Mario Berta , Fernando G. S. L. Brandão , Joel A. Tropp

The variational quantum eigensolver (VQE) is one of the most promising algorithms for low-lying eigenstates calculation on Noisy Intermediate-Scale Quantum (NISQ) computers. Specifically, VQE has achieved great success for ground state…

Numerical Analysis · Mathematics 2025-12-19 Hengzhun Chen , Yingzhou Li , Bichen Lu , Jianfeng Lu

The variational quantum eigensolver (VQE), a variational algorithm to obtain an approximated ground state of a given Hamiltonian, is an appealing application of near-term quantum computers. The original work [A. Peruzzo et al.; \textit{Nat.…

Quantum Physics · Physics 2019-11-06 Ken M Nakanishi , Kosuke Mitarai , Keisuke Fujii

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

Calculations of highly excited and delocalized molecular vibrational states are computationally challenging tasks, which strongly depends on the choice of coordinates for describing vibrational motions. We introduce a new method that…

We describe a protocol for preparing the ground state of a Hamiltonian $H$ on a quantum computer. This is done by designing a quantum algorithm that implements the imaginary time evolution operator: $e^{-\tau H}$. The method relies on the…

Quantum Physics · Physics 2023-06-28 Charles Marteau

Variational calculations of excited electronic states are carried out by finding saddle points on the surface that describes how the energy of the system varies as a function of the electronic degrees of freedom. This approach has several…

Chemical Physics · Physics 2023-02-15 Yorick L. A. Schmerwitz , Gianluca Levi , Hannes Jónsson

We propose a new theoretical approach to ground and low-energy excited states of nuclei extending the nuclear mean-field theory. It consists of three steps: stochastic preparation of many Slater determinants, the parity and angular momentum…

Nuclear Theory · Physics 2009-11-11 S. Shinohara , H. Ohta , T. Nakatsukasa , K. Yabana

The ground state properties of quantum many-body systems are a subject of interest across chemistry, materials science, and physics. Thus, algorithms for finding ground states can have broad impacts. Variational quantum algorithms are one…

Quantum Physics · Physics 2023-09-28 James B. Larsen , Matthew D. Grace , Andrew D. Baczewski , Alicia B. Magann

We show that, in certain circumstances, exact excitation energies appear as locally site-independent (or flat) modes if one records the excitation spectrum of the effective Hamiltonian while sweeping through the lattice in the variational…

Strongly Correlated Electrons · Physics 2017-08-24 Natalia Chepiga , Frédéric Mila

We compare recently proposed methods to compute the electronic state energies of the water molecule on a quantum computer. The methods include the phase estimation algorithm based on Trotter decomposition, the phase estimation algorithm…

Quantum Physics · Physics 2019-07-24 Teng Bian , Daniel Murphy , Rongxin Xia , Ammar Daskin , Sabre Kais

We construct superposition states of energy eigenstates of the hydrogen molecule using classically emulated digital quantum simulation. We generate the ground state and excited states of the system via the twirling operation method, and…

Quantum Physics · Physics 2025-11-06 Kazuto Oshima

We apply black-box methods, i.e. where the performance of the method does not depend upon initial guesses, to extract excited-state energies from Euclidean-time hadron correlation functions. In particular, we extend the widely used…

High Energy Physics - Lattice · Physics 2009-10-29 George T. Fleming , Saul D. Cohen , Huey-Wen Lin , Victor Pereyra

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

We compare the results of ground state and spectroscopic measurements carried out on superconducting flux qubits which are effective two-level quantum systems. For a single qubit and for two coupled qubits we show excellent agreement…

The generating function of a Hamiltonian $H$ is defined as $F(t)=\langle e^{-itH}\rangle$, where $t$ is the time and where the expectation value is taken on a given initial quantum state. This function gives access to the different moments…

Quantum Physics · Physics 2021-11-29 Edgar Andres Ruiz Guzman , Denis Lacroix

We describe how to create ab-initio effective Hamiltonians that qualitatively describe correct chemistry even when used with a minimal basis. The Hamiltonians are obtained by folding correlation down from a large parent basis into a small,…

Chemical Physics · Physics 2015-02-18 Thomas J. Watson , Garnet Kin-Lic Chan

We present a new method for calculating ground state properties of quantum dots in high magnetic fields. It takes into account the equilibrium positions of electrons in a Wigner cluster to minimize the interaction energy in the high field…

Mesoscale and Nanoscale Physics · Physics 2009-11-07 J. Kainz , S. A. Mikhailov , A. Wensauer , U. Roessler

Variational-Quantum-Eigensolver (VQE) method has been known as the method of chemical calculation using quantum computers and classical computers. This method also can derive the energy levels of excited states by…

Quantum Physics · Physics 2021-09-07 Hikaru Wakaura , Takao Tomono