Photodissociation of ozone in the Chappuis band. III. Product state distributions

Heiner Flöthmann; Reinhard Schinke; Clemens Woywod; Wolfgang Domcke

doi:10.1063/1.476867

Photodissociation of ozone in the Chappuis band. III. Product state distributions

Heiner Flöthmann, Reinhard Schinke, Clemens Woywod, Wolfgang Domcke

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21 Scopus citations

Abstract

We discuss the vibrational and rotational state distributions of ground-state O₂ following the photodissociation of O₃ in the Chappuis band. They are obtained from time-dependent wave packet calculations employing ab initio potential energy surfaces for the 1¹A^″ and 2¹A^″ electronic states and the nonadiabatic elements, which couple these states. The satisfying agreement with experimental results underlines that the essential mechanisms of this two-state process are well described.

Original language	English
Pages (from-to)	2680-2684
Number of pages	5
Journal	Journal of Chemical Physics
Volume	109
Issue number	7
DOIs	https://doi.org/10.1063/1.476867
State	Published - 1998
Externally published	Yes

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title = "Photodissociation of ozone in the Chappuis band. III. Product state distributions",

abstract = "We discuss the vibrational and rotational state distributions of ground-state O2 following the photodissociation of O3 in the Chappuis band. They are obtained from time-dependent wave packet calculations employing ab initio potential energy surfaces for the 11A″ and 21A″ electronic states and the nonadiabatic elements, which couple these states. The satisfying agreement with experimental results underlines that the essential mechanisms of this two-state process are well described.",

author = "Heiner Fl{\"o}thmann and Reinhard Schinke and Clemens Woywod and Wolfgang Domcke",

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AU - Flöthmann, Heiner

AU - Schinke, Reinhard

AU - Woywod, Clemens

AU - Domcke, Wolfgang

PY - 1998

Y1 - 1998

N2 - We discuss the vibrational and rotational state distributions of ground-state O2 following the photodissociation of O3 in the Chappuis band. They are obtained from time-dependent wave packet calculations employing ab initio potential energy surfaces for the 11A″ and 21A″ electronic states and the nonadiabatic elements, which couple these states. The satisfying agreement with experimental results underlines that the essential mechanisms of this two-state process are well described.

AB - We discuss the vibrational and rotational state distributions of ground-state O2 following the photodissociation of O3 in the Chappuis band. They are obtained from time-dependent wave packet calculations employing ab initio potential energy surfaces for the 11A″ and 21A″ electronic states and the nonadiabatic elements, which couple these states. The satisfying agreement with experimental results underlines that the essential mechanisms of this two-state process are well described.

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Photodissociation of ozone in the Chappuis band. III. Product state distributions

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