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Imaginary time evolution is a powerful technique for computing the ground state of quantum Hamiltonians, where the convergence to ground state in asymptotic imaginary time is guaranteed. However, implementing this method on quantum…

Quantum Physics · Physics 2025-06-17 S. Alipour , T. Ojanen

The imaginary-time evolution of quantum states is integral to various fields, ranging from natural sciences to classical optimization or machine learning. Since simulating quantum imaginary-time evolution generally requires storing an…

Quantum Physics · Physics 2024-01-17 Julien Gacon , Christa Zoufal , Giuseppe Carleo , Stefan Woerner

Quantum computers have been widely speculated to offer significant advantages in obtaining the ground state of difficult Hamiltonian in chemistry and physics. In this work, we first propose a Lyapunov control-inspired strategy to accelerate…

Quantum Physics · Physics 2022-12-21 Yu-Cheng Chen , Yu-Qin Chen , Alice Hu , Chang-Yu Hsieh , Shengyu Zhang

Imaginary time evolution is a powerful tool for studying quantum systems. While it is possible to simulate with a classical computer, the time and memory requirements generally scale exponentially with the system size. Conversely, quantum…

Quantum Physics · Physics 2019-09-17 Sam McArdle , Tyson Jones , Suguru Endo , Ying Li , Simon Benjamin , Xiao Yuan

Evolution in imaginary time is a prominent technique for finding the ground state of quantum many-body systems, and the heart of a number of numerical methods that have been used with great success in quantum chemistry, condensed matter and…

Imaginary-time evolution is fundamental for analyzing quantum many-body systems, yet classical simulation requires exponentially growing resources in both system size and evolution time. While quantum approaches reduce the system-size…

Quantum Physics · Physics 2025-12-12 Lei Zhang , Jizhe Lai , Xian Wu , Xin Wang

Phenomena analogous to ground state quantum phase transitions have recently been noted to occur among states throughout the excitation spectra of certain many-body models. These excited state phase transitions are manifested as simultaneous…

Quantum Physics · Physics 2008-05-06 M. A. Caprio , P. Cejnar , F. Iachello

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

Calculating the energy spectrum of a quantum system is an important task, for example to analyse reaction rates in drug discovery and catalysis. There has been significant progress in developing algorithms to calculate the ground state…

Quantum Physics · Physics 2019-06-12 Suguru Endo , Tyson Jones , Sam McArdle , Xiao Yuan , Simon Benjamin

The accurate computation of Hamiltonian ground, excited, and thermal states on quantum computers stands to impact many problems in the physical and computer sciences, from quantum simulation to machine learning. Given the challenges posed…

Highly excited states of quantum many-body systems are central objects in the study of quantum dynamics and thermalization that challenge classical computational methods due to their volume-law entanglement content. In this work, we explore…

Quantum Physics · Physics 2022-02-17 Feng Zhang , Niladri Gomes , Yongxin Yao , Peter P. Orth , Thomas Iadecola

Quantum Imaginary-Time Evolution (QITE) is a powerful method for preparing ground states on quantum hardware. However, executing QITE has costly measurement budgets for general Hamiltonians. Both fidelity and computational cost are strongly…

Quantum Physics · Physics 2025-12-12 Julio Del Castillo , Mats Granath , Evert van Nieuwenburg

Utilizing quantum computer to investigate quantum chemistry is an important research field nowadays. In addition to the ground-state problems that have been widely studied, the determination of excited-states plays a crucial role in the…

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…

Excited-state quantum phase transitions extend the quantum phase transition concept beyond the ground state and offer insights into the complex behavior of quantum systems. In the present work, we assess the use of the multiple quantum…

Quantum Physics · Physics 2025-03-04 Qian Wang , Francisco Pérez-Bernal

Imaginary-time evolution plays an important role in algorithms for computing ground-state and thermal equilibrium properties of quantum systems, but can be challenging to simulate on classical computers. Many quantum algorithms for…

Quantum Physics · Physics 2025-07-22 Annie Ray , Esha Swaroop , Ningping Cao , Michael Vasmer , Anirban Chowdhury

We propose an excited-state molecular dynamics simulation method based on variational quantum algorithms at a computational cost comparable to that of ground-state simulations. We utilize the feature that excited states can be obtained as…

Chemical Physics · Physics 2023-03-02 Hirotoshi Hirai

Imaginary time evolution is a powerful tool applied in quantum physics, while existing classical algorithms for simulating imaginary time evolution suffer high computational complexity as the quantum systems become larger and more complex.…

Quantum Physics · Physics 2022-10-12 Hao-Nan Xie , Shi-Jie Wei , Fan Yang , Zheng-An Wang , Chi-Tong Chen , Heng Fan , Gui-Lu Long

We consider quantum many-body systems evolving under a time-independent Hamiltonian $H$ from a nonequilibrium initial state at time $t=0$ towards a close-to-equilibrium state at time $t=\tau$. Subsequently, this state is slightly perturbed…

Statistical Mechanics · Physics 2020-05-27 Lennart Dabelow , Peter Reimann

There is increasing interest in quantum algorithms that are based on the imaginary-time evolution (ITE), a successful classical numerical approach to obtain ground states. However, most of the proposals so far require heavy post-processing…

Quantum Physics · Physics 2023-01-05 Pejman Jouzdani , Calvin W. Johnson , Eduardo R. Mucciolo , Ionel Stetcu
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