THE PHOTODISSOCIATION OF SIO

Citation
G. Jolicard et al., THE PHOTODISSOCIATION OF SIO, The Journal of chemical physics, 106(24), 1997, pp. 10105-10112
Citations number
37
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
ISSN journal
00219606
Volume
106
Issue
24
Year of publication
1997
Pages
10105 - 10112
Database
ISI
SICI code
0021-9606(1997)106:24<10105:TPOS>2.0.ZU;2-7
Abstract
The photodissociation of the SiO molecule, which is of considerable as trophysical interest, is studied within the framework of the Floquet t heory. Only the one-photon transition process between the two lowest ( 1) Sigma(+) states is considered. The computation of the electronic en ergy surfaces is performed with the MOLPRO code. The wave operator the ory is used to select the active space related to this process, and to build the Floquet resonance states which constitute this active space . Particular attention is paid to the role of the shape resonance stat es induced by the presence of a barrier on the E (1) Sigma(+) surface. (C) 1997 American Institute of Physics.