Ab initio study of the mixing of valence and Rydberg states in O2: CI potential curves for the3Σu−,3Δu and3Πu states
- 15 July 1975
- journal article
- Published by Elsevier in Chemical Physics Letters
- Vol. 34 (2), 225-231
- https://doi.org/10.1016/0009-2614(75)85260-2
Abstract
No abstract availableKeywords
This publication has 6 references indexed in Scilit:
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- Theoretical study of the vertical electronic spectrum of O2: Mixing of valence and Rydberg statesChemical Physics, 1975
- Individualized configuration selection in CI calculations with subsequent energy extrapolationTheoretical Chemistry Accounts, 1974
- Comparison of various CI treatments for the description of potential curves for the lowest three states of O2Chemical Physics Letters, 1972
- Curve Crossing of the B Σu−3 and Π u3 States of O2 and Its Relation to Predissociation in the Schumann—Runge BandsThe Journal of Chemical Physics, 1971
- A Natural Orbital Based Energy Calculation for Helium Hydride and Lithium HydrideThe Journal of Physical Chemistry, 1966