|
|||||
|
|
The Water‐Exchange Mechanism of the [UO2(OH2)5]2+ Ion Revisited: The Importance of a Proper Treatment of Electron Correlation |
|
| Authors: | François Rotzinger PD Dr. |
| Affiliation: | Institut des Sciences et Ingéniere Chimiques, Ecole Polytechnique Fédérale de Lausanne (EPFL), Station 6, CH‐1015 Lausanne, Switzerland, Fax: (+?41)?21‐693‐4111 |
| Abstract: | |
| Keywords: | ab initio calculations ligand effects quantum chemical calculations substitution mechanisms uranium water chemistry |