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Off-resonance photoemission dynamics studied by recoil frame F1s and C1s photoelectron angular distributions of CH3F

STENER, MAURO
•
DECLEVA, PIETRO
•
T. Mizuno
altro
A. Yagishita
2014
  • journal article

Periodico
THE JOURNAL OF CHEMICAL PHYSICS
Abstract
F1s and C1s photoelectron angular distributions are considered for CH3F, a molecule which does not support any shape resonance. In spite of the absence of features in the photoionization cross section profile, the recoil frame photoelectron angular distributions (RFPADs) exhibits dramatic changes depending on both the photoelectron energy and polarization geometry. Time-dependent density functional theory calculations are also given to rationalize the photoionization dynamics. The RFPADs have been compared with the theoretical calculations, in order to assess the accuracy of the theoretical method and rationalize the experimental findings. The effect of finite acceptance angles for both ionic fragments and photoelectrons has been included in the calculations, as well as the effect of rotational averaging around the fragmentation axis. Excellent agreement between theory and experiment is obtained, confirming the good quality of the calculated dynamical quantities (dipole moments and phase shifts).
DOI
10.1063/1.4862267
WOS
WOS:000331211700031
Archivio
http://hdl.handle.net/11368/2813324
info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-84901785050
Diritti
metadata only access
Soggetti
  • photoionization

Web of Science© citazioni
8
Data di acquisizione
Mar 26, 2024
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