Article ID Journal Published Year Pages File Type
5394092 Computational and Theoretical Chemistry 2013 7 Pages PDF
Abstract

- The effect of chemical modification on thiophene-based N3 dyes is studied.
- Theoretical studies are performed with DFT and TD-DFT.
- Increased electron-withdrawing ability of dyes facilitates charge transfer to TiO2.
- The charge transfer is unaffected when the conjugation length is extended.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
, , , , ,