Exchange Coupling Interactions from the Density Matrix Renormalization Group and N-Electron Valence Perturbation Theory: Application to a Biomimetic Mixed-Valence Manganese Complex |
Authors: Römelt, Michael; Krewald, Vera; Pantazis, Dimitrios | Date of Publication (YYYY-MM-DD): 2018-01 | Title of Journal: Journal of Chemical Theory and Computation | Volume: 14 | Issue / Number: 1 | Start Page: 166 | End Page: 179 | Document Type: Article | ID: 735582.0 |
|
|