Photophysical properties of [Ru(phen)2(dppz)2+ intercalated into DNA: An integrated Car-Parrinello and TDDFT study
Academic Article
Publication Date:
2005
abstract:
Combined Car-Parrinello and time-dependent DFT calculations performed on [Ru(phen)2dppz]2+ intercalated into an adenine-thymine tetramer reveal a remarkable influence of the base pairs in determining the electronic structure and the character of the excited states involved in the absorption and emission processes.
Iris type:
01.01 Articolo in rivista
List of contributors:
Sgamellotti, Antonio; DE ANGELIS, Filippo; Fantacci, Simona
Published in: