A mixed quantum-classical description of pheophorbide a linear absorption spectra: Quantum-corrections of the Q(y)- and Q(x)-absorption vibrational satellites
- The ground-state classical path approximation is utilized to compute molecular absorption spectra in a mixed quantum-classical frame. To improve the description for high-frequency vibrational satellites, related quantum correction factors are introduced. The improved method is demonstrated for the Q(y),and Q(x)-bands of pheophorbide a. (C) 2015 Elsevier B.V. All rights reserved.
| Author details: | Jörg MegowGND, Alexander Kulesza, Volkhard May |
|---|---|
| DOI: | https://doi.org/10.1016/j.cplett.2015.11.016 |
| ISSN: | 0009-2614 |
| ISSN: | 1873-4448 |
| Title of parent work (English): | Chemical physics letters |
| Publisher: | Elsevier |
| Place of publishing: | Amsterdam |
| Publication type: | Article |
| Language: | English |
| Year of first publication: | 2016 |
| Publication year: | 2016 |
| Release date: | 2020/03/22 |
| Volume: | 643 |
| Number of pages: | 5 |
| First page: | 61 |
| Last Page: | 65 |
| Funding institution: | Deutsche Forschungsgemeinschaft [ME 4215/2-1]; COST Action [CM1405] |
| Organizational units: | Mathematisch-Naturwissenschaftliche Fakultät / Institut für Chemie |
| Peer review: | Referiert |
