Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
1324154 | Journal of Organometallic Chemistry | 2005 | 10 Pages |
Abstract
The structures and electronic states of phenyl-capped terthiophene (denoted by P3T) and the ionic species of P3T have been investigated by means of density functional theory (DFT) and direct MO dynamics calculations. P3T is one of the high-performance molecular devices, which has been utilized as a semi-conductor.
Keywords
Related Topics
Physical Sciences and Engineering
Chemistry
Inorganic Chemistry
Authors
Hiroto Tachikawa, Hiroshi Kawabata, Kenji Ishida, Kazumi Matsushige,