Ab initio valence bond calculations are performed for the three lowest states of the oxygen molecule ('Xi, \*Ag, and '2;). One objective of the present study was to make a contribution to previous valence bond discussions about the oxygen "double" bond. Further, we study the origin of a small barrie
A Valence Bond Study of the Low-Lying States of the NF Molecule
β Scribed by Peifeng Su; Wei Wu; Sason Shaik; Philippe C. Hiberty
- Publisher
- John Wiley and Sons
- Year
- 2008
- Tongue
- English
- Weight
- 356 KB
- Volume
- 9
- Category
- Article
- ISSN
- 1439-4235
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