A theoretical study of the nonlinear optical second-order susceptibilities of (CH3)2N(C6H4)nCN series molecules

Acta Chimica Sinica ›› 1993, Vol. 51 ›› Issue (4): 334-340. Previous Articles Next Articles

Original Articles

(CH3)2N(C6H4)nCN系列分子二阶非线性光学系数的理论研究

于宏石;封继康;李君;李志儒

吉林大学化学系

发布日期:1993-04-15

A theoretical study of the nonlinear optical second-order susceptibilities of (CH3)2N(C6H4)nCN series molecules

YU HONGSHI;FENG JIKANG;LI JUN;LI ZHIRU

Published:1993-04-15

Abstract

Based on AM1 and INDO/CI methods, using the program for calcns. of the nonlinear optical second-order susceptibilities (bijk), (bijk) and (bm) were calculated for (CH3)2N(C6H4)nCN series mols., n = 1 ?6. A systematic study is reported of the effect of conjugation length on the mol. nonlinear optical second-order susceptibilities and investigated the laser frequency dependences (dispersions) of (bm) are discussed.

Key words: COMPUTER APPLICATIONS, BENZIDINE P, NON LINEAR OPTICS, BENZONITRILE P, DISPERSION, INTERMEDIATE NEGLECT OF DIFFERENTIAL OVERLAP APPROXIMATION (IND, SECONDARY AMINE P

CLC Number:

O641

Cite this article

YU HONGSHI;FENG JIKANG;LI JUN;LI ZHIRU. A theoretical study of the nonlinear optical second-order susceptibilities of (CH3)2N(C6H4)nCN series molecules[J]. Acta Chimica Sinica, 1993, 51(4): 334-340.

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(CH3)2N(C6H4)nCN系列分子二阶非线性光学系数的理论研究

A theoretical study of the nonlinear optical second-order susceptibilities of (CH3)2N(C6H4)nCN series molecules

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