Theoretical study on the electronic structure, spectrum  and nonlinear second-order optical property of C~5~9HN

Acta Chimica Sinica ›› 1999, Vol. 57 ›› Issue (6): 541-545. Next Articles

Original Articles

C~5~9HN的电子结构、UV-vis光谱及非线性光学性质的理论研究

任爱民;封继康;李伟;孙秀云;李志儒

吉林大学理论化学计算国家重点实验室;吉林大学超分子结构及谱学开放实验室

发布日期:1999-06-15

Theoretical study on the electronic structure, spectrum and nonlinear second-order optical property of C~5~9HN

Ren Aimin;Feng Jikang;Li Wei;Sun Xiuyun;Li Zhiru

Published:1999-06-15

Abstract

We have conducted a theoretical study on the azafullerene C~5~9HN with the INDO series methods, and obtained the following results: electronic structure, molecular stability, UV-vis spectrum and nonlinear second-order optical susceptibility.

Key words: CAGE STRUCTURE, ELECTRONIC STRUCTURE, FULLERENES, ULTRAVIOLET SPECTROPHOTOMETRY, NON LINEAR OPTICS, OPTICAL PROPERTIES

CLC Number:

O641

Cite this article

Ren Aimin;Feng Jikang;Li Wei;Sun Xiuyun;Li Zhiru. Theoretical study on the electronic structure, spectrum and nonlinear second-order optical property of C~5~9HN[J]. Acta Chimica Sinica, 1999, 57(6): 541-545.

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C~5~9HN的电子结构、UV-vis光谱及非线性光学性质的理论研究

Theoretical study on the electronic structure, spectrum and nonlinear second-order optical property of C~5~9HN

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