Investigation of the Resonance Raman Spectra and Excitation Profiles of a Monometallic Ruthenium(II) [Ru(bpy)2(HAT)]2+Complex by Time-Dependent Density Functional Theory

2010 ◽  
Vol 114 (1) ◽  
pp. 511-520 ◽  
Author(s):  
Julien Guthmuller ◽  
Benoît Champagne ◽  
Cécile Moucheron ◽  
Andrée Kirsch - De Mesmaeker
Keyword(s):  
Density Functional Theory ◽  
Raman Spectra ◽  
Density Functional ◽  
Resonance Raman ◽  
Time Dependent ◽  
Functional Theory ◽  
Resonance Raman Spectra ◽  
Dependent Density

Time-dependent density functional theory simulation of hyper-Raman spectra

2005 ◽  
Vol 106 (3) ◽  
pp. 599-608 ◽  
Author(s):  
Olivier Quinet ◽  
Benoît Champagne ◽  
Stan J. A. Van Gisbergen
Keyword(s):  
Density Functional Theory ◽  
Raman Spectra ◽  
Density Functional ◽  
Time Dependent ◽  
Functional Theory ◽  
Dependent Density

Resonance Raman Spectra and Electronic Transitions in Carotenoids: A Density Functional Theory Study

2014 ◽  
Vol 118 (10) ◽  
pp. 1817-1825 ◽  
Author(s):  
Mindaugas Macernis ◽  
Juozas Sulskus ◽  
Svetlana Malickaja ◽  
Bruno Robert ◽  
Leonas Valkunas
Keyword(s):  
Density Functional Theory ◽  
Raman Spectra ◽  
Density Functional ◽  
Resonance Raman ◽  
Electronic Transitions ◽  
Density Functional Theory Study ◽  
Functional Theory ◽  
Resonance Raman Spectra
Sign in / Sign up

Export Citation Format

Share Document