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Stochastic Simulation of Nonadiabatic Dynamics at Long Time

2010/03/16 by Daniel A. Uken, Uken, Daniel A., Alessandro Sergi +3
Physics and Astronomy · #Advanced Thermodynamics and Statistical Mechanics #FOS: Physical sciences #Quantum Physics (quant-ph) #Quantum chaos and dynamical systems #Theoretical and Computational Physics

paper · pdf · doi:10.48550/arxiv.1003.3117

openalex publication_date 2010/03/16 · openalex created_date 2025/10/10 · openalex updated_date 2026/07/28

Abstract

Using a generalized energy-conserving transition probability, it is shown how nonadiabatic calculations, within the Wigner-Heisenberg representation of quantum mechanics, can be reliably extended to far longer times than those allowed by a primitive sampling scheme. Tackling the spin-boson model as a paradigmatic example, substantial numerical evidence is provided that effective integration of the dynamics can be achieved for a wide range of temperatures and friction.

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