Literature DB >> 24116551

A hybrid stochastic hierarchy equations of motion approach to treat the low temperature dynamics of non-Markovian open quantum systems.

Jeremy M Moix1, Jianshu Cao.   

Abstract

The hierarchical equations of motion technique has found widespread success as a tool to generate the numerically exact dynamics of non-Markovian open quantum systems. However, its application to low temperature environments remains a serious challenge due to the need for a deep hierarchy that arises from the Matsubara expansion of the bath correlation function. Here we present a hybrid stochastic hierarchical equation of motion (sHEOM) approach that alleviates this bottleneck and leads to a numerical cost that is nearly independent of temperature. Additionally, the sHEOM method generally converges with fewer hierarchy tiers allowing for the treatment of larger systems. Benchmark calculations are presented on the dynamics of two level systems at both high and low temperatures to demonstrate the efficacy of the approach. Then the hybrid method is used to generate the exact dynamics of systems that are nearly impossible to treat by the standard hierarchy. First, exact energy transfer rates are calculated across a broad range of temperatures revealing the deviations from the Förster rates. This is followed by computations of the entanglement dynamics in a system of two qubits at low temperature spanning the weak to strong system-bath coupling regimes.

Year:  2013        PMID: 24116551     DOI: 10.1063/1.4822043

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  5 in total

1.  Coarse-grained representation of the quasi adiabatic propagator path integral for the treatment of non-Markovian long-time bath memory.

Authors:  Martin Richter; Benjamin P Fingerhut
Journal:  J Chem Phys       Date:  2017-06-07       Impact factor: 3.488

2.  An extension of stochastic hierarchy equations of motion for the equilibrium correlation functions.

Authors:  Yaling Ke; Yi Zhao
Journal:  J Chem Phys       Date:  2017-06-07       Impact factor: 3.488

3.  Possible role of interference, protein noise, and sink effects in nonphotochemical quenching in photosynthetic complexes.

Authors:  Gennady P Berman; Alexander I Nesterov; Shmuel Gurvitz; Richard T Sayre
Journal:  J Math Biol       Date:  2016-04-30       Impact factor: 2.259

4.  Simulation of Quantum Dynamics of Excitonic Systems at Finite Temperature: an efficient method based on Thermo Field Dynamics.

Authors:  Raffaele Borrelli; Maxim F Gelin
Journal:  Sci Rep       Date:  2017-08-22       Impact factor: 4.379

5.  Quantum Chemical Modeling of the Photoinduced Activity of Multichromophoric Biosystems.

Authors:  Francesco Segatta; Lorenzo Cupellini; Marco Garavelli; Benedetta Mennucci
Journal:  Chem Rev       Date:  2019-07-05       Impact factor: 60.622

  5 in total

北京卡尤迪生物科技股份有限公司 © 2022-2023.