The first hyperpolarizability of some chiral carboxylates by hyper-Rayleigh scattering measurements and theoretical calculations

2004 ◽  
Author(s):  
O. Castellano ◽  
X. Hernandez ◽  
N. Cubillan ◽  
M. Giffard ◽  
Mamadou Sylla ◽  
...  
2020 ◽  
Author(s):  
Zeyu Liu ◽  
Shugui Hua ◽  
Tian Lu ◽  
Ziqi Tian

Inspired by a previous experimental study on the first-order hyperpolarizabilities of 1,3-thiazolium-5-thiolates mesoionic compounds using Hyper-Rayleigh scattering technique, we theoretically investigated the UV-Vis absorption spectra and every order polarizabilities of these mesoionic molecules. Based on the fact that the photophysical and nonlinear properties observed in the experiment can be perfectly replicated, our theoretical calculations explored the essential characteristics of the optical properties of the mesoionic compounds with different electron-donating groups at the level of electronic structures through various wave function analysis methods. The influence of the electron-donating ability of the donor on the optical properties of the molecules and the contribution of the mesoionic ring moiety to their optical nonlinearity are clarified, which have not been reported by any research so far. This work will help people understand the nature of optical properties of mesoionic-based molecules and provide guidance for the rational design of molecules with excellent photoelectric performance in the future.


AIAA Journal ◽  
1991 ◽  
Vol 29 (2) ◽  
pp. 242-246 ◽  
Author(s):  
B. Shirinzadeh ◽  
M. E. Hillard ◽  
R. J. Exton

2010 ◽  
Vol 115 (1) ◽  
pp. 23-30 ◽  
Author(s):  
Yannick Mugnier ◽  
Latifa Houf ◽  
Moustafa El-Kass ◽  
Ronan Le Dantec ◽  
Rachid Hadji ◽  
...  

2019 ◽  
Vol 7 (42) ◽  
pp. 13052-13058 ◽  
Author(s):  
Nana Ma ◽  
Mingyue Lv ◽  
Tongxin Liu ◽  
Mengxiao Song ◽  
Yan Liu ◽  
...  

The theoretical calculations show that [60]fullerene-fused dihydrocarboline derivatives exhibit significant first hyperpolarizability contrasts induced by their electrochemical feature.


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