FRAGMENTATION DYNAMICS OF THE PHOTO-DISSOCIATED TRIATOMIC MOLECULE

Authors
Citation
Pg. Harper et J. Pfab, FRAGMENTATION DYNAMICS OF THE PHOTO-DISSOCIATED TRIATOMIC MOLECULE, Molecular physics, 78(6), 1993, pp. 1337-1350
Citations number
26
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
Journal title
ISSN journal
00268976
Volume
78
Issue
6
Year of publication
1993
Pages
1337 - 1350
Database
ISI
SICI code
0026-8976(1993)78:6<1337:FDOTPT>2.0.ZU;2-8
Abstract
A theory is presented of the angular momentum distribution of diatomic fragments ejected in the photodissociation of triatomic molecules. Th e theory is based on semi-classical dynamics and treats dissociation f rom an ensemble of nuclear configurations reflecting the zero-point os cillations of the parent molecule. The mean angular momentum of the di atomic is determined by the range parameter of the repulsive potential , while the width of its distribution is determined by the gradient pa rameters of the potential surface as expressed in the Franck-Condon sp atial and angular coordinates. The odd moments of the asymmetrical dis tribution are related to the nonlinear part of the potential energy su rface. Using available experimental data, the model is applied to the photodissociation of NOCl at 440 nm, leading to an estimated value of 0.2 eV rad-1 for the local angular gradient of the repulsive potential , and a consequent lower limit of 20 fs for the fragmentation time.