It has been observed that electronically excited states of molecules occasionally have a different amount of Rydberg character even though they arise from the same electronic configuration. Recent examples are CO\* and CaHa. We try to explain this fact with the aid of a consideration due to Merer an
✦ LIBER ✦
ππ*Transition of ethylene: electron correlation and Rydberg character
✍ Scribed by B. Levy; J. Ridard
- Publisher
- Elsevier Science
- Year
- 1972
- Tongue
- English
- Weight
- 407 KB
- Volume
- 15
- Category
- Article
- ISSN
- 0009-2614
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✦ Synopsis
The excircd singlet (n r;*) state of planar ethylene is calculated in ;I CT0 basis set by a second-order perturbation method. It is shown that the transition energy is nearly independent of the Rydberg character of the x* orbital and therefore electron correlation is introdnced.
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