화학공학소재연구정보센터
검색결과 : 5건
No. Article
1 Predicting Keto-Enol Equilibrium from Combining UV/Visible Absorption Spectroscopy with Quantum Chemical Calculations of Vibronic Structures for Many Excited States. A Case Study on Salicylideneanilines
Zutterman F, Louant O, Mercier G, Leyssens T, Champagne B
Journal of Physical Chemistry A, 122(24), 5370, 2018
2 Time-dependent density functional theory investigation of the absorption and emission spectra of a cyanine dye
Guillaume M, Liegeois V, Champagne B, Zutterman F
Chemical Physics Letters, 446(1-3), 165, 2007
3 TDDFT investigation of the optical properties of cyanine dyes
Champagne B, Guillaume M, Zutterman F
Chemical Physics Letters, 425(1-3), 105, 2006
4 Investigation of the UV/visible absorption spectra of merocyanine dyes using time-dependent density functional theory
Guillaume M, Champagne B, Zutterman F
Journal of Physical Chemistry A, 110(48), 13007, 2006
5 Approaches to calculation of exciton interaction energies for a molecular dimer
Howard IA, Zutterman F, Deroover G, Lamoen D, Van Alsenoy C
Journal of Physical Chemistry B, 108(50), 19155, 2004