| Literature DB >> 22457957 |
Abstract
In this contribution, advantages and disadvantages of the time-independent and time-dependent approaches for Franck-Condon profile calculations are discussed within the displaced-distorted-rotated harmonic oscillator approximation. Particular strengths and prospects of a previously developed time-independent cumulant expansion in the calculation of a Franck-Condon profile for UV/Vis absorption spectra are demonstrated for the specific case of the S0(1Ag) --> S1(1B3u) transition of terrylene at various temperatures.Entities:
Mesh:
Substances:
Year: 2011 PMID: 22457957 DOI: 10.1039/c0fd00014k
Source DB: PubMed Journal: Faraday Discuss ISSN: 1359-6640 Impact factor: 4.008