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We review techniques for simulating fully quantum nonadiabatic dynamics using the frozen-width moving Gaussian basis functions to represent the nuclear wavefunction. A choice of these basis functions is primarily motivated by the idea of…

Chemical Physics · Physics 2018-09-05 Loïc Joubert-Doriol , Artur F. Izmaylov

This study examines the potential for fault-tolerant quantum computers to provide utility in fluid dynamics simulations, with a focus on drag force calculations for ship hull design. We assess whether quantum algorithms can surpass…

Non-Hermitian systems have been at the center of intense research for over a decade, partly due to their nontrivial energy topology formed by intersecting Riemann manifolds with branch points known as exceptional points (EPs). This spectral…

We present a novel quantum-classical approach to non-adiabatic dynamics, deduced from the coupled electronic and nuclear equations in the framework of the exact factorization of the electron-nuclear wave function. The method is based on the…

Chemical Physics · Physics 2015-08-19 Seung Kyu Min , Federica Agostini , E. K. U. Gross

A fundamental and intrinsic property of any device or natural system is its relaxation time relax, which is the time it takes to return to equilibrium after the sudden change of a control parameter [1]. Reducing $tau$ relax , is frequently…

Statistical Mechanics · Physics 2016-10-25 Ignacio Martinez , Artyom Petrosyan , David Guéry-Odelin , Emmanuel Trizac , Sergio Ciliberto

Quantum simulation of non-Markovian open quantum dynamics is essential but challenging for standard quantum computers due to their non-Hermitian nature, leading to non-unitary evolution, and the limitations of available quantum resources.…

Quantum Physics · Physics 2026-01-12 Yukai Guo , Xing Gao

In adiabatic quantum computing the aim is to track an eigenstate as the Hamiltonian changes. In the usual setup this is achieved using the natural time-dependent Hamiltonian evolution of the system and the main technical tool is the…

Quantum Physics · Physics 2026-05-29 Joseph Cunningham , Jérémie Roland

We consider a coupled system of Schr\"odinger equations, arising in quantum mechanics via the so-called time-dependent self-consistent field method. Using Wigner transformation techniques we study the corresponding classical limit dynamics…

Analysis of PDEs · Mathematics 2014-06-17 Shi Jin , Christof Sparber , Zhennan Zhou

We develop perturbative methods to study and control dynamical phenomena related to exceptional points in Non-Hermitian systems. In particular, we show how to find perturbative solutions based on the Magnus expansion that accurately…

Quantum Physics · Physics 2021-11-23 Hugo Ribeiro , Florian Marquardt

In a recent Phys. Rev. E Rapid Communication, the authors, Silvestrov and Beenakker, introduce a way to lengthen the Ehrenfest time, $\tau$, for fully chaotic systems. We disagree with several statements made in their paper, and address the…

Chaotic Dynamics · Physics 2009-11-07 Steven Tomsovic , Eric J. Heller

While adiabatic quantum computing (AQC) has some robustness to noise and decoherence it is widely believed that encoding, error suppression and error correction will be required to scale AQC to large problem sizes. Previous works have…

Quantum Physics · Physics 2014-01-06 Mohan Sarovar , Kevin C. Young

Using the exact eigenstates of the inhomogeneous Dicke model obtained by numerically solving the Bethe equations, we study the decay of bosonic excitations due to the coupling of the mode to an ensemble of two-level (spin 1/2) systems. We…

Mesoscale and Nanoscale Physics · Physics 2012-11-06 Christoph Sträter , Oleksandr Tsyplyatyev , Alexandre Faribault

Far out-of-equilibrium many-body quantum dynamics in isolated systems necessarily generate interferences beyond an Ehrenfest time scale, where quantum and classical expectation values diverge. Of great recent interest is the role these…

Quantum Physics · Physics 2018-06-20 Steven Tomsovic , Peter Schlagheck , Denis Ullmo , Juan Diego Urbina , Klaus Richter

We show that the recently proposed interacting Ehrenfest M-urn model at equilibrium can be exactly mapped to a mean-field M-state Potts model. By exploiting this correspondence, we show that the M-state Potts model with M >= 3, with…

Statistical Mechanics · Physics 2024-02-19 Chi-Ho Cheng , Pik-Yin Lai

Despite its long history, a canonical formulation of quantum ergodicity that applies to general classes of quantum dynamics, including driven systems, has not been fully established. Here we introduce and study a notion of quantum…

Quantum Physics · Physics 2024-12-10 Saúl Pilatowsky-Cameo , Iman Marvian , Soonwon Choi , Wen Wei Ho

Exceptional points (EPs) have attracted extensive research interest due to their intriguing properties. One of the hallmarks of EP physics is that dynamically encircling the EPs induces chiral mode switching, arising from the breakdown of…

A novel mixed quantum-classical approach to simulating nonadiabatic dynamics of molecules at metal surfaces is presented. The method combines the numerically exact hierarchical equations of motion approach for the quantum electronic degrees…

Mesoscale and Nanoscale Physics · Physics 2024-05-06 Samuel L. Rudge , Christoph Kaspar , Robin L. Grether , Steffen Wolf , Gerhard Stock , Michael Thoss

Characterization of non-Markovian open quantum dynamics is both of theoretical and practical relevance. In a seminal work [Phys. Rev. Lett. 120, 040405 (2018)], a necessary and sufficient quantum Markov condition is proposed, with a clear…

Quantum Physics · Physics 2022-08-24 Chu Guo

Mixed-quantum classical (MQC) methods for simulating the dynamics of molecules at metal surfaces have the potential to accurately and efficiently provide mechanistic insight into reactive processes. Here, we introduce simple two-dimensional…

Chemical Physics · Physics 2023-08-02 James Gardner , Scott Habershon , Reinhard J. Maurer

Multitime quantum correlation functions are central objects in physical science, offering a direct link between experimental observables and the dynamics of an underlying model. While experiments such as 2D spectroscopy and quantum control…

Chemical Physics · Physics 2024-07-10 Thomas Sayer , Andrés Montoya-Castillo