| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5387576 | Chemical Physics Letters | 2008 | 5 Pages |
Abstract
TDDFT gives wrong excited state surfaces (dashed lines) in the homolytic dissociation limit due to the excitation energy going to zero (full lines: exact surfaces).
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
K.J.H. Giesbertz, E.J. Baerends,