Citation: Dong-Er GAN, Zhang ZHANG, Qiao-Hong LI, Wen-Mu LI. Oligo(aromatic ether sulfone)-F as a Nonlinear Polarized Polymeric Material: an Experiment and DFT Study[J]. Chinese Journal of Structural Chemistry, ;2021, 40(3): 383-393. doi: 10.14102/j.cnki.0254–5861.2011–2878 shu

Oligo(aromatic ether sulfone)-F as a Nonlinear Polarized Polymeric Material: an Experiment and DFT Study

Dong-Er GAN ^{a, c} ,
Zhang ZHANG ^{b, c} ,
Qiao-Hong LI ^b ,
Wen-Mu LI ^a,,

a.
Key Laboratory of Optoelectronic Materials Chemistry and Physics, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou 350002, China
b.
State Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou 350002, China
c.
University of Chinese Academy of Sciences, Beijing 100049, China

Corresponding author: Wen-Mu LI, liwm@fjirsm.ac.cn
Received Date: 15 May 2020
Accepted Date: 23 December 2020

Figures(9)

Polymeric membranes with diverse structures have attracted much attention as new materials for nonlinear optical devices. In this report, a novel oligomer of poly (aromatic ether sulfone) (OAES) has been synthesized and characterized. The electronic structure as well as linear and nonlinear optical properties has been studied by density function theory. The effect for general nonlinear optical polarizability of various condition has been further researched such as absence of side chains and introduction of phenyl substituent on side chains. The static and frequency-dependent hyperpolarizabilities of OAES and its derivatives have been calculated. This work interprets an efficient adjustment for the frequency response and the intensity of nonlinear optical polarizability can be achieved by regulating the structure of system, which provides a new potential for the application of oligomeric materials on nonlinear optical field.
- DFT method,
- NLO properties,
- oligo(aromatic ether sulfone)-F,
- sum-over-states method
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