Master Thesis Online
Photoabsorption and photoelectron spectra of trichloroethylene and tetrachloroethylene: a joint experimental and theoretical approach
Gaida, Meriem 
Promotor(s) :
Leyh, Bernard
;
Mignolet, Benoît
Date of defense : 1-Jul-2019 • Permalink : http://hdl.handle.net/2268.2/6955
s145234GAIDA2019.pdfDetails
| Title : | Photoabsorption and photoelectron spectra of trichloroethylene and tetrachloroethylene: a joint experimental and theoretical approach |
| Author : | Gaida, Meriem
|
| Date of defense : | 1-Jul-2019 |
| Advisor(s) : | Leyh, Bernard
Mignolet, Benoît
|
| Committee's member(s) : | Remacle, Françoise
Eppe, Gauthier
|
| Language : | English |
| Keywords : | [en] Photoelectron spectroscopy, Franck-Condon principle, Vibronic spectra, Duschinsky matrix, DFT, TD-DFT [en] Photoabsorption spectroscopy, mixed valence-Rydberg character [en] Basis sets |
| Discipline(s) : | Physical, chemical, mathematical & earth Sciences > Chemistry |
| Institution(s) : | Université de Liège, Liège, Belgique |
| Degree: | Master en sciences chimiques, à finalité approfondie |
| Faculty: | Master thesis of the Faculté des Sciences |
Abstract
[en] The study of the vibrational structure observed in the photoelectron spectra of trichloroethylene and tetrachloroethylene and in the photoabsorption spectrum of trichloroethylene by comparing the measured spectra to computed vibrationally-resolved spectra using state of the art electronic structure computations.
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