Performance of DFT functionals for calculating the second-order nonlinear optical properties of dipolar merocyanines

2020 ◽  
Vol 22 (29) ◽  
pp. 16579-16594 ◽  
Author(s):  
Laurie Lescos ◽  
Sebastian P. Sitkiewicz ◽  
Pierre Beaujean ◽  
Mireille Blanchard-Desce ◽  
Benoît Champagne ◽  
...  
Keyword(s):  
Optical Properties ◽  
Ab Initio ◽  
Nonlinear Optical ◽  
Second Order ◽  
Nonlinear Optical Properties

Evolution of the static HRS hyperpolarizability of a tricyanopropylidene-based merocyanine dye with the length of the polyenic bridge, as calculated using various ab initio and DFT approximations.

Second-order nonlinear optical properties of two chalcone derivatives: insights from sum-over-states

2021 ◽  
Author(s):  
Jean Custodio ◽  
Giulio Demetrius Creazo d'Oliveira ◽  
Fernando Gotardo ◽  
Leandro Cocca ◽  
Leonardo De Boni ◽  
...  
Keyword(s):  
Optical Properties ◽  
Nonlinear Optical ◽  
Theoretical Study ◽  
Second Order ◽  
Nonlinear Optical Properties ◽  
Chalcone Derivatives

In the following study, a combined experimental and theoretical study of the nonlinear optical properties (NLO) of two chalcone derivatives, (E)-3-(2-methoxyphenyl)-1-(2-(phenylsulfonylamine)phenyl)prop-2-en-1-one (MPSP) and (E)-3-(3-nitrophenyl)-1-(2-(phenylsulfonylamine)phenyl)prop-2-en-1-one (NPSP) in DMSO is reported. Single...

scholarly journals An excursion in the second-order nonlinear optical properties of platinum complexes

2021 ◽  
Vol 446 ◽  
pp. 214113
Author(s):  
Alessia Colombo ◽  
Claudia Dragonetti ◽  
Véronique Guerchais ◽  
Dominique Roberto
Keyword(s):  
Optical Properties ◽  
Nonlinear Optical ◽  
Platinum Complexes ◽  
Second Order ◽  
Nonlinear Optical Properties

The Li-substituted effect on the geometries and second-order nonlinear optical properties of indeno[1,2-b]fluorene

2014 ◽  
Vol 1031 ◽  
pp. 7-12 ◽  
Author(s):  
Hongjuan Song ◽  
Mengying Zhang ◽  
Hailing Yu ◽  
Cunhuan Wang ◽  
Haiyan Zou ◽  
...  
Keyword(s):  
Optical Properties ◽  
Nonlinear Optical ◽  
Second Order ◽  
Nonlinear Optical Properties ◽  
Substituted Effect
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