Accurate Nonlinear Optical Properties of Solvated para-Nitroaniline Predicted by an Electrostatic Discrete Local Field Approach

2020 ◽  
Vol 124 (45) ◽  
pp. 10195-10209
Author(s):  
Tomáš Hrivnák ◽  
Heribert Reis ◽  
Pavel Neogrády ◽  
Robert Zaleśny ◽  
Miroslav Medved’
Langmuir ◽  
1993 ◽  
Vol 9 (8) ◽  
pp. 1974-1977 ◽  
Author(s):  
Gerard Cnossen ◽  
Karel E. Drabe ◽  
Douwe A. Wiersma ◽  
Monique A. Schoondorp ◽  
Arend Jan Schouten ◽  
...  

RSC Advances ◽  
2016 ◽  
Vol 6 (97) ◽  
pp. 94437-94450 ◽  
Author(s):  
Georgia Maria A. Junqueira ◽  
João Paulo A. Mendonça ◽  
Alessandro Henrique Lima ◽  
Welber G. Quirino ◽  
Fernando Sato

Through DFT calculations and the finite field approach, it is possible to identify some structural and electronic aspects that could lead to enhancement of the nonlinear optical (NLO) molecular properties of graphene oxide and its derivatives.


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