A THEORETICAL RE-EXAMINATION OF THE UV PHOTODISSOCIATION SPECTRA OF HI AND DI

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Date

1999

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Ohio State University

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Abstract

Since the detailed theoretical study Levy and Shapiroa over a decade ago, incisive new experimental studies have been reported which contradict older measurements of the anisotropy parameters associated with the I(2P1/2) dissociation channels, but disagree among themselves regarding the magnitude of the branching ratio between the I(2P3/2) and I(2P1/2)channels.b,c Previous theoretical studies have also tended to focus on HI, and inconsistently model or overlook apparent discrepancies with the total photodissociation cross-sections for DI. This paper reports our progress on a theoretical re-examination of this system which uses direct least-squares fits to all of the various types of data to attempt to delineate better the underlying potential energy curves and transition moment functions.

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aI. Levy and M. Shapiro, J. Chem. Phys. 89, 2900 (1988) bS.R. Langford, P.M. Regan, A.J. Orr-Ewing and M.N.R. Ashfold, Chem. Phys. 231, 245 (1998) cD. Gendron and J.W. Hepburn, J. Chem. Phys. 109, 7204 (1998)


Author Institution: Guelph-Waterloo Centre for Graduate Work in Chemistry and Biochemistry, University of Waterloo

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