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  Charge and energy transfer in large molecular assemblies: Quantum state diffusion with an adaptive basis

Gao, X., & Eisfeld, A. (2019). Charge and energy transfer in large molecular assemblies: Quantum state diffusion with an adaptive basis. The Journal of Chemical Physics, 150(23): 234115. doi:10.1063/1.5095578.

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 Creators:
Gao, Xing1, Author           
Eisfeld, Alexander1, Author           
Affiliations:
1Max Planck Institute for the Physics of Complex Systems, Max Planck Society, ou_2117288              

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 MPIPKS: Dynamics on nanoscale systems
 Abstract: We show that the stochastic, wave-function based quantum state diffusion approach in combination with an adaptive basis is well suited to numerically treat the motion of an excitation in large molecular aggregates in the complicated regime where the transfer-time between molecules is comparable to the decoherence caused by environmental degrees of freedom.

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 Dates: 2019-06-212019-11-01
 Publication Status: Issued
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 Table of Contents: -
 Rev. Type: -
 Identifiers: ISI: 000472600300011
DOI: 10.1063/1.5095578
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Title: The Journal of Chemical Physics
  Other : J. Chem. Phys.
Source Genre: Journal
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Publ. Info: Woodbury, N.Y. : American Institute of Physics
Pages: - Volume / Issue: 150 (23) Sequence Number: 234115 Start / End Page: - Identifier: ISSN: 0021-9606
CoNE: https://pure.mpg.de/cone/journals/resource/954922836226