Theoretical Studies on the Third-order Nonlinear Optical Properties and Two-photon Absorption of Stilbene Derivatives

被引:0
作者
任爱民
封继康
刘孝娟
机构
[1] State Key Laboratory of Theoretical and Computational Chemistry, Institute of Theoretical Chemistry , Jilin University, Changchun, Jilin 130023, China,State Key Laboratory of Theoretical and Computational Chemistry, Institute of Theoretical Chemistry , Jil
[2] College of Chemistry, Jilin University, Changchun, Jilin 130023, China ,State Key Laboratory of Theoretical and Computational Chemistry, Institute of Theoretical Chemistry , Jilin University, Changchun, Jilin 130023, China
基金
中国国家自然科学基金;
关键词
stilbene derivative; electronic spectrum; two-photon absorption cross-section;
D O I
暂无
中图分类号
O647.3 [吸附];
学科分类号
070304 ; 081704 ;
摘要
Different types of stilbene derivatives (D-p-D, A-p-A, D-p-A) were investigated with AM1, and specially, equilibrium geometries of symmetrical stilbene derivatives (D-p-D) were studied using of PM3. With the same method INDO/CI, the UV-vis spectra were explored and the position and strength of the two-photon absorption were predicated by Sum-Over-States expression. The relationships of the structures, spectra and nonlinear optical properties have been examined. The influence of various substituents on two photon absorption cross-sections was discussed micromechanically.
引用
收藏
页码:243 / 251 +220
页数:10
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