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A potential approach for demonstrating quantum advantage is using quantum computers to simulate fermionic systems. Quantum algorithms for fermionic system simulation usually involve the Hamiltonian evolution and measurements. However, in…

Quantum Physics · Physics 2025-05-14 Qing-Song Li , Jiaxuan Zhang , Huan-Yu Liu , Qingchun Wang , Yu-Chun Wu , Guo-Ping Guo

Molecular dynamics simulations provide theoretical insight into the microscopic behavior of materials in condensed phase and, as a predictive tool, enable computational design of new compounds. However, because of the large temporal and…

Chemical Physics · Physics 2020-06-18 Wujie Wang , Rafael Gómez-Bombarelli

We present a model of discrete quantum evolution based on quantum correlations between the evolving system and a reference quantum clock system. A quantum circuit for the model is provided, which in the case of a constant Hamiltonian is…

Quantum Physics · Physics 2016-07-06 A. Boette , R. Rossignoli , N. Gigena , M. Cerezo

The dynamics of open quantum systems can be simulated by unraveling it into an ensemble of pure state trajectories undergoing non-unitary monitored evolution, which has recently been shown to undergo measurement-induced entanglement phase…

Quantum Physics · Physics 2025-03-26 Zhuo Chen , Yimu Bao , Soonwon Choi

The real- and imaginary-time evolution of quantum states are powerful tools in physics, chemistry, and beyond, to investigate quantum dynamics, prepare ground states or calculate thermodynamic observables. On near-term devices, variational…

Quantum Physics · Physics 2024-02-27 Julien Gacon , Jannes Nys , Riccardo Rossi , Stefan Woerner , Giuseppe Carleo

We introduce a dynamical evolution operator for dealing with unstable physical process, such as scattering resonances, photon emission, decoherence and particle decay. With that aim, we use the formalism of rigged Hilbert space and…

Quantum Physics · Physics 2018-07-16 Marcelo Losada , Sebastian Fortin , Manuel Gadella , Federico Holik

We introduce a new class of quantum models with time-dependent Hamiltonians of a special scaling form. By using a couple of time-dependent unitary transformations, the time evolution of these models is expressed in terms of related systems…

Quantum Physics · Physics 2009-11-07 L. Samaj

Building on recent advances in quantum algorithms which measure and reuse qubits and in efficient classical simulation leveraging projective measurements, we extend these frameworks to real-time dynamics of quantum many-body systems…

Quantum Physics · Physics 2025-12-08 Bo Xiao , Benedikt Kloss , E. Miles Stoudenmire

The issue of separating Schr\"odinger-type quantum time evolution into a product of holonomic and dynamical parts in the non-adiabatic non-Abelian case is examined. We identify all special cases in which this kind of separation is possible,…

Quantum Physics · Physics 2026-02-24 Adam Fredriksson , Erik Sjöqvist

Simulation of quantum systems is notoriously challenging for classical computers, while quantum hardware is naturally well-suited for this task. However, the imperfections of contemporary quantum systems poses a considerable challenge in…

Quantum Physics · Physics 2025-01-10 Yotam Shapira , Jovan Markov , Nitzan Akerman , Ady Stern , Roee Ozeri

Coarse-graining or model reduction is a term describing a range of approaches used to extend the time-scale of molecular simulations by reducing the number of degrees of freedom. In the context of molecular simulation, standard…

Dynamical Systems · Mathematics 2023-11-14 Thomas Hudson , Xingjie Helen Li

Dynamical maps describe general transformations of the state of a physical system, and their iteration can be interpreted as generating a discrete time evolution. Prime examples include classical nonlinear systems undergoing transitions to…

Quantum Physics · Physics 2013-11-19 P. Schindler , M. Müller , D. Nigg , J. T. Barreiro , E. A. Martinez , M. Hennrich , T. Monz , S. Diehl , P. Zoller , R. Blatt

We present efficient quantum algorithms for simulating time-dependent Hamiltonian evolution of general input states using an oracular model of a quantum computer. Our algorithms use either constant or adaptively chosen time steps and are…

Quantum Physics · Physics 2011-11-03 Nathan Wiebe , Dominic W. Berry , Peter Hoyer , Barry C. Sanders

The physics of a closed quantum mechanical system is governed by its Hamiltonian. However, in most practical situations, this Hamiltonian is not precisely known, and ultimately all there is are data obtained from measurements on the system.…

We present an efficient quantum algorithm for simulating the evolution of a sparse Hamiltonian H for a given time t in terms of a procedure for computing the matrix entries of H. In particular, when H acts on n qubits, has at most a…

Quantum Physics · Physics 2007-05-23 Dominic W. Berry , Graeme Ahokas , Richard Cleve , Barry C. Sanders

Quantum process characterization is a fundamental task in quantum information processing, yet conventional methods, such as quantum process tomography, require prohibitive resources and lack scalability. Here, we introduce an efficient…

Quantum Physics · Physics 2025-04-11 Yusen Wu , Yukun Zhang , Chuan Wang , Xiao Yuan

The incoherent dynamical properties of open quantum systems are generically attributed to an ongoing correlation between the system and its environment. Here, we propose a novel way to assess the nature of these system-environment…

Quantum Physics · Physics 2018-01-23 Hong-Bin Chen , Clemens Gneiting , Ping-Yuan Lo , Yueh-Nan Chen , Franco Nori

We consider an open quantum system with Hamiltonian $H_S$ whose spectrum is given by a generalized Fibonacci sequence weakly coupled to a Boson reservoir in equilibrium at inverse temperature $\beta$. We find the generator of the reduced…

Quantum Physics · Physics 2022-05-12 Franco Fagnola , Chul Ki Ko , Hyun Jae Yoo

Designing quantum algorithms for simulating quantum systems has seen enormous progress, yet few studies have been done to develop quantum algorithms for open quantum dynamics despite its importance in modeling the system-environment…

Quantum Physics · Physics 2022-02-11 Zixuan Hu , Rongxin Xia , Sabre Kais

Coarse-graining has become an area of tremendous importance within many different research fields. For molecular simulation, coarse-graining bears the promise of finding simplified models such that long-time simulations of large-scale…

Chemical Physics · Physics 2019-09-04 Feliks Nüske , Lorenzo Boninsegna , Cecilia Clementi