Jahn-Teller effect and on-site interaction for
- 1 February 1995
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 51 (6) , 3493-3497
- https://doi.org/10.1103/physrevb.51.3493
Abstract
The lowering of the total energy due to the electron-vibration interaction is calculated for molecules and the electron-vibration contribution to the on-site interaction is obtained. It is found that is in the intermediate- to strong-coupling limit, and that the vibration contribution to the on-site interaction if of the order -0.1 to -0.2 eV for n=1 and 3 and of the order +0.3 eV for n=2 and 4.
Keywords
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