| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5390200 | Chemical Physics Letters | 2006 | 6 Pages |
Abstract
Contour plots of the 4a1 and 2b2 orbitals are shown below. The changes of sign of Ï between the O and H atoms graphically show O-H anti-bonding character. The orbitals extend well beyond the molecular centers illustrating contributions of Rydberg character.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Paul S. Bagus, Christof Wöll, Eugene S. Ilton,