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Molecular Rydberg states. VII. Water

Journal Article · · J. Chem. Phys.; (United States)
DOI:https://doi.org/10.1063/1.435173· OSTI ID:7218494

The optical absorption spectra of H/sub 2/O and D/sub 2/O are reported at various pressures for 2000> or =lambda> or =950 A. The 1670 A band is vibrationally structured (..nu../sub 2/ bend) and the excited /sup 1/B/sub 1/ state contains a considerable intravalence 4a/sub 1/ component. The 1280 A state 3sa/sub 1/; /sup 1/A/sub 1/ is linear and dominantly Rydberg. A Renner--Teller analysis of the 1280 A band leads to detection of a perturbing state at 1365 A which may be assigned as a bent, heavily Rydberg 3sa/sub 1/; /sup 1/B/sub 1/ state. A reanalysis of K-shell excitation spectra bolsters this 3sa/sub 1/; /sup 1/B/sub 1/ assignment. Isotope shift studies in the 1130--980 A region lead to some vibronic reassignments. The terminal state of the 968 A absorption band is a linear 5sa/sub 1/; /sup 1/A/sub 1/ state. In sum, a total of 21 electronic states, comprising fragments of six Rydberg series, have been assigned.

Research Organization:
Coates Chemical Laboratories, Louisiana State University, Baton Rouge, Louisiana 70803
OSTI ID:
7218494
Journal Information:
J. Chem. Phys.; (United States), Journal Name: J. Chem. Phys.; (United States) Vol. 67:6; ISSN JCPSA
Country of Publication:
United States
Language:
English