| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5394935 | Computational and Theoretical Chemistry | 2011 | 7 Pages |
Abstract
⺠Four Re(I) metal complexes were investigated theoretically. ⺠LUMO energies decrease effectively much more than that of HOMO. ⺠Complex 4 with -COOCH3 groups has the smallest HOMO-LUMO energy gaps. ⺠The lowest lying absorption bands of these complexes all come from the HOMO-1 â LUMO transition.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Feng Zhao, Jie-xiu Wang, Yi-bo Wang,