Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5394536 | Computational and Theoretical Chemistry | 2012 | 6 Pages |
Abstract
⺠The electronic structure of fullerenes derivatives has been discussed. ⺠The nonlinear optical properties of fullerenes derivatives have been analyzed. ⺠The [5, 6]-benzyne monoadduct is more stable than the [6, 6]-benzyne monoadduct. ⺠TTF derivatives have large second-order nonlinear optical properties. ⺠The nature of excited state has been described by using TDDFT calculations.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Chun-Guang Liu,