Coupled-cluster studies of the lowest excited states of the 11-cis-retinal chromophore

The first few excited states of the 11-cis-retinal (PSB11) chromophore have been studied at the coupled-cluster approximative singles and doubles (CC2) level using triple-zeta quality basis sets augmented with double sets of polarisation functions. The two lowest vertical excitation energies of 2.14...

Ausführliche Beschreibung

Bibliographische Detailangaben

Veröffentlicht in:	Physical chemistry chemical physics : PCCP 2007-06, Vol.9 (22), p.2862
Hauptverfasser:	Send, Robert, Sundholm, Dage
Format:	Artikel
Sprache:	eng
Schlagworte:	Cluster Analysis Computer Simulation Dose-Response Relationship, Radiation Light Models, Chemical Models, Molecular Radiation Dosage Retinaldehyde - chemistry Retinaldehyde - radiation effects
Online-Zugang:	Volltext
Tags:	Tag hinzufügen Keine Tags, Fügen Sie den ersten Tag hinzu!