Published September 1, 1977
| Published
Journal Article
Open
An SCF-stabilization approach to excited states embedded in the continuum
Abstract
By using SCF and stabilization‐like procedures, we have located a (π, π*) singlet resonance‐like state in ethylene at 10.21 eV. This state is embedded in the ionization continuum and carries an oscillator strength of 0.46 and is probably the analog to the spectroscopic V state in Hartree–Fock theory. Implications of these results for other systems are discussed.
Additional Information
© 1977 American Institute of Physics. This work was performed under the auspices of the U.S. Energy Research and Development Administration under contract No. W-7405-Eng-48. Contribution No. 5455.Attached Files
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Additional details
- Eprint ID
- 32750
- Resolver ID
- CaltechAUTHORS:20120726-122418094
- W-7405-Eng-48
- Energy Research and Development Administration
- Created
-
2012-07-30Created from EPrint's datestamp field
- Updated
-
2021-11-09Created from EPrint's last_modified field
- Other Numbering System Name
- Caltech Arthur Amos Noyes Laboratory of Chemical Physics
- Other Numbering System Identifier
- 5455