English
Related papers

Related papers: A variational surface hopping algorithm for the su…

200 papers

A theoretical justification of the empirical surface hopping method for the laser-driven molecular dynamics is given utilizing the formalism of the exact factorization of the molecular wavefunction [Abedi et al., PRL $\textbf{105}$, 123002…

Chemical Physics · Physics 2017-07-05 T. Fiedlschuster , J. Handt , E. K. U. Gross , R. Schmidt

Vibrational dynamics of adsorbates near surfaces plays both an important role for applied surface science and as model lab for studying fundamental problems of open quantum systems. We employ a previously developed model for the relaxation…

Chemical Physics · Physics 2022-07-01 Eric W. Fischer , Michael Werther , Foudhil Bouakline , Frank Grossmann , Peter Saalfrank

The use of stochastic models, in effect piecewise deterministic Markov processes (PDMP), has become increasingly popular especially for the modeling of chemical reactions and cell biophysics. Yet, exact simulation methods, for the…

Numerical Analysis · Mathematics 2015-04-28 Romain Veltz

We develop a multi-state generalisation of the recently proposed mapping approach to surface hopping (MASH) for the simulation of electronically nonadiabatic dynamics. This new approach extends the original MASH method to be able to treat…

Chemical Physics · Physics 2024-03-19 Joseph E. Lawrence , Jonathan R. Mannouch , Jeremy O. Richardson

We consider two dynamical variants of Dvoretzky's classical problem of random interval coverings of the unit circle, the latter having been completely solved by L. Shepp. In the first model, the centers of the intervals perform independent…

Probability · Mathematics 2008-04-22 Johan Jonasson , Jeffrey E. Steif

With extensive variational simulations, dissipative quantum phase transitions in the sub-Ohmic spin-boson model are numerically studied in a dense limit of environmental modes. By employing a generalized trial wave function composed of…

Statistical Mechanics · Physics 2023-09-06 Yulong Shen , Nengji Zhou

The horizontal dynamics of a bouncing ball interacting with an irregular surface is investigated and is found to demonstrate behavior analogous to a random walk. Its stochastic character is substantiated by the calculation of a permutation…

Physics Education · Physics 2025-09-15 Luiz Antonio Barreiro

In a recent article [Phys. Rev. Lett. 97 (2006), 107206], we have presented a class of states which is suitable as a variational set to find ground states in spin systems of arbitrary spatial dimension and with long-range entanglement.…

Quantum Physics · Physics 2007-10-06 Simon Anders , Hans J. Briegel , Wolfgang Dür

Coarse-grained modeling of dynamics on vicinal surfaces concentrates on the diffusion of adatoms on terraces with boundary conditions at sharp steps, as first studied by Burton, Cabrera and Frank (BCF). Recent electromigration experiments…

Materials Science · Physics 2009-11-10 T. Zhao , J. D. Weeks , D. Kandel

The Nielsen-Thurston theory of surface diffeomorphisms shows that useful dynamical information can be obtained about a surface diffeomorphism from a finite collection of periodic orbits.In this paper, we extend these results to homoclinic…

Dynamical Systems · Mathematics 2007-05-23 Pieter Collins

The famous domino shuffling algorithm was invented to generate the domino tilings of the Aztec Diamond. Using the domino height function, we view the domino shuffling procedure as a discrete-time random height process on the plane. The…

Probability · Mathematics 2019-05-10 Xufan Zhang

We investigate the dynamics of the spin-boson model when the spectral density of the boson bath shows a resonance at a characteristic frequency $\Omega$ but behaves Ohmically at small frequencies. The time evolution of an initial state is…

Condensed Matter · Physics 2009-11-10 M. Thorwart , E. Paladino , M. Grifoni

Circular Dyson Brownian motion describes the Brownian dynamics of particles on a circle (periodic boundary conditions), interacting through a logarithmic, long-range two-body potential. Within the log-gas picture of random matrix theory, it…

Statistical Mechanics · Physics 2024-06-11 Wouter Buijsman

Hopping transport in a one-dimensional system is studied numerically. A fast algorithm is devised to find the lowest-resistance path at arbitrary electric field. Probability distribution functions of individual resistances on the path and…

Disordered Systems and Neural Networks · Physics 2009-10-16 A. S. Rodin , M. M. Fogler

This paper studies the problem of optimal switching for one-dimensional diffusion, which may be regarded as sequential optimal stopping problem with changes of regimes. The resulting dynamic programming principle leads to a system of…

Probability · Mathematics 2007-05-23 Huyen Pham

The spin-boson model, describing a two-level system strongly coupled to a bosonic bath, is extensively studied as a paradigmatic dissipative quantum system, exhibiting rich dynamical behavior and even a localization transition in the strong…

Quantum Physics · Physics 2024-08-20 Naushad Ahmad Kamar , Daniel A. Paz , Mohammad F. Maghrebi

Intersystem crossing is a radiationless process that can take place in a molecule irradiated by UV-Vis light, thereby playing an important role in many environmental, biological and technological processes. This paper reviews different…

Chemical Physics · Physics 2017-03-29 Sebastian Mai , Philipp Marquetand , Leticia González

We develop a data-driven characterization of the pilot-wave hydrodynamic system in which a bouncing droplet self-propels along the surface of a vibrating bath. We consider drop motion in a confined one-dimensional geometry, and apply the…

Fluid Dynamics · Physics 2022-10-14 J. Nathan Kutz , Andre Nachbin , Peter J. Baddoo , John W. M. Bush

We investigate Landau-Zener (LZ) transitions in the three-level bow-tie model (3L-BTM) in a dissipative environment by using the numerically accurate method of multiple Davydov D2 Ansatze. We first consider the 3L-TBM coupled to a single…

Quantum Physics · Physics 2023-11-20 Lixing Zhang , Maxim F. Gelin , Yang Zhao

Autonomous agents are limited in their ability to observe the world state. Partially observable Markov decision processes (POMDPs) formally model the problem of planning under world state uncertainty, but POMDPs with continuous actions and…

Robotics · Computer Science 2020-07-08 Dicong Qiu , Yibiao Zhao , Chris L. Baker