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We introduce a novel computational framework for excited-states molecular quantum dynamics simulations driven by quantum computing-based electronic-structure calculations. This framework leverages the fewest-switches surface-hopping method…

Quantum Physics · Physics 2024-02-26 Anthony Gandon , Alberto Baiardi , Pauline Ollitrault , Ivano Tavernelli

Hybrid quantum systems harness the distinct advantages of different physical platforms, yet their integration is not always trivial due to potential incompatibilities in operational principles. Here, we theoretically propose and demonstrate…

Quantum Physics · Physics 2025-12-09 Xuxin Wang , Jiahe Pan , Tobias J. Kippenberg , Shingo Kono

Non-Markovianity may significantly speed up quantum dynamics when the system interacts strongly with an infinite large reservoir, of which the coupling spectrum should be fine-tuned. The potential benefits are evident in many dynamics…

Quantum Physics · Physics 2022-02-07 Xiangyi Meng , Yang Li , Jian-Wei Zhang , Hong Guo , H. Eugene Stanley

Reducing computational scaling for simulating non-Markovian dissipative dynamics using artificial neural networks is both a major focus and formidable challenge in open quantum systems. To enable neural quantum states (NQSs), we encode…

Quantum Physics · Physics 2026-03-10 Long Cao , Liwei Ge , Daochi Zhang , Xiang Li , Yao Wang , Rui-Xue Xu , YiJing Yan , Xiao Zheng

Classically simulating quantum systems is challenging, as even noiseless $n$-qubit quantum states scale as $2^n$. The complexity of noisy quantum systems is even greater, requiring $2^n \times 2^n$-dimensional density matrices. Various…

Quantum Physics · Physics 2025-04-24 Taylor L. Patti , Thien Nguyen , Justin G. Lietz , Alexander J. McCaskey , Brucek Khailany

Reliable processing of quantum information is a milestone to achieve for the deployment of quantum technologies. Uncontrolled, out-of-equilibrium sources of decoherence need to be characterized in detail for designing the control of quantum…

Quantum Physics · Physics 2023-10-26 Martin Kuffer , Analia Zwick , Gonzalo A. Alvarez

Excited state properties play a pivotal role in various chemical and physical phenomena, such as charge separation and light emission. However, the primary focus of most existing quantum algorithms has been the ground state, as seen in…

We present a numerical path-integral iteration scheme for the low dimensional reduced density matrix of a time-dependent quantum dissipative system. Our approach simultaneously accounts for the combined action of a microscopically modelled…

Quantum Physics · Physics 2016-10-12 A. M. Barth , A. Vagov , V. M. Axt

Two-dimensional electronic spectroscopy (2DES) provides a detailed picture of electronically nonadiabatic dynamics that can be interpreted with the aid of simulations. Here, we develop and contrast trajectory-based nonadiabatic dynamics…

We consider a class of non-equilibrium pure states, which are generally present in an isolated quantum statistical system. These are states of the form $|\Psi\rangle=e^{-{\beta H \over 2}} U e^{{\beta H \over 2}} |\Psi_0\rangle$, where $U$…

High Energy Physics - Theory · Physics 2017-08-22 Kyriakos Papadodimas

The dissipation and decoherence (for example, the effects of noise in quantum computations), interaction with thermostat or in general with physical vacuum, measurement and many other complicated problems of open quantum systems are a…

Mathematical Physics · Physics 2007-05-23 Ashot S. Gevorkyan

We develop a method to study quantum impurity models, small interacting quantum systems linearly coupled to an environment, in presence of an additional Markovian quantum bath, with a generic non-linear coupling to the impurity. We aim at…

Quantum Physics · Physics 2025-03-10 Orazio Scarlatella , Marco Schirò

The computation of excited states in strongly interacting quantum many-body systems is of fundamental importance. Yet, it is notoriously challenging due to the exponential scaling of the Hilbert space dimension with the system size. Here,…

Quantum Physics · Physics 2025-06-11 Yixuan Ma , Chang Liu , Weikang Li , Shun-Yao Zhang , L. -M. Duan , Yukai Wu , Dong-Ling Deng

Quantum systems coupled to (non-)Markovian environments attract increasing attention due to their peculiar physical properties. Exciting prospects such as unconventional non-equilibrium phases beyond the Mermin-Wagner limit, or the…

Quantum Physics · Physics 2025-09-10 Philipp Westhoff , Mattia Moroder , Ulrich Schollwöck , Sebastian Paeckel

Non-equilibrium transport properties of quantum systems have recently become experimentally accessible in a number of platforms in so-called full-counting experiments that measure transient and steady state non-equilibrium transport…

Quantum Physics · Physics 2016-12-28 Javier Cerrillo , Maximilian Buser , Tobias Brandes

We introduce a technique that allows one to connect any two arbitrary (pure or mixed) superposition states of an N-state quantum system. The proposed solution to this inverse quantum mechanical problem is analytical, exact, and very…

Quantum Physics · Physics 2009-11-13 P. A. Ivanov , B. T. Torosov , N. V. Vitanov

We describe the decoherence process induced on a two-level quantum system in direct interaction with a non-equilibrium environment. The non-equilibrium feature is represented by a non-stationary random function corresponding to the…

Quantum Physics · Physics 2015-06-15 Fernando C. Lombardo , Paula I. Villar

We outline a non-perturbative approach for simulating the behavior of open quantum systems interacting with a bosonic environment defined by a generalized spectral density function. The method is based on replacing the environment by a set…

Quantum Physics · Physics 2021-08-13 Graeme Pleasance , Francesco Petruccione

Incoherent stochastic processes added to unitary dynamics are typically deemed detrimental since they are expected to diminish quantum features such as superposition and entanglement. Instead of exhibiting energy-conserving persistent…

By modeling the interaction of an open quantum system with its environment through a natural generalization of the classical concept of continuous time random walk, we derive and characterize a class of non-Markovian master equations whose…

Quantum Physics · Physics 2018-01-31 Adrián A. Budini