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Volumn 119, Issue 5, 2003, Pages 2761-2773

Modeling of ultrafast electron-transfer processes: Validity of multilevel Redfield theory

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; QUANTUM THEORY; SPECTROSCOPIC ANALYSIS; TENSORS;

EID: 0042012699     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1587121     Document Type: Article
Times cited : (161)

References (94)
  • 2
    • 0011526199 scopus 로고    scopus 로고
    • Electron transfer: From isolated molecules to biomolecules
    • Wiley, New York
    • Electron Transfer: From Isolated Molecules to Biomolecules, Advances in Chemical Physics Vol. 106-107, edited by J. Jortner and M. Bixon, (Wiley, New York, 1999).
    • (1999) Advances in Chemical Physics , vol.106-107
    • Jortner, J.1    Bixon, M.2
  • 62
    • 0042791219 scopus 로고    scopus 로고
    • note
    • s.
  • 63
    • 0041789033 scopus 로고    scopus 로고
    • note
    • For a discussion of Redfield theory including correlations between system and bath in the initial state see, for example, Refs. 58 and 92.
  • 64
    • 0042791218 scopus 로고    scopus 로고
    • note
    • Some authors use the term "Markov approximation" for the combination of step (ii) and the replacement of the upper integration limit / in Eq. (2.10) by infinity, which results in a time evolution described by a semigroup. In this paper, the additional approximation, where the upper "integration limit is replaced by infinity, is referred to as the stationary Redfield tensor approximation.
  • 72
    • 0042290196 scopus 로고    scopus 로고
    • note
    • c can only be considered as a rough estimate.
  • 76
    • 0041789032 scopus 로고    scopus 로고
    • note
    • This failure of the lowest order perturbation theory to describe decay rates in systems with a large mismatch between the system frequency and the characteristic frequency of the bath is well known from the theory of vibrational relaxation processes (Refs. 93 and 94).
  • 86
    • 0042791216 scopus 로고    scopus 로고
    • note
    • Another method that has been proposed to discretize the continuous spectral density of the bath in certain physical limits is the surrogate Hamiltonian (Refs. 88 and 87), where only a few modes and a single excitation of each mode is considered. This procedure is, however, not adequate for a numerical exact treatment of the examples considered in this paper.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.