THEORETICAL AND EXPERIMENTAL STUDIES OF THE MOLECULAR 2ND-ORDER NONLINEAR-OPTICAL RESPONSES OF HETEROAROMATIC-COMPOUNDS

被引:67
作者
WONG, KY [1 ]
JEN, AKY [1 ]
RAO, VP [1 ]
DROST, KJ [1 ]
机构
[1] ENICHEM AMER INC,CTR RES & DEV,MONMOUTH JCT,NJ 08852
关键词
D O I
10.1063/1.467041
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The present theoretical and experimental studies of the molecular second order nonlinear optical response of donor-acceptor substituted conjugated compounds which consist of heteroaromatic moieties in place of the traditional benzenoid moieties. Electric-field-induced second harmonic generation measurement at a fundamental wavelength of 1.907 mu m demonstrated a twofold increase of the off-resonant molecular hyperpolarizability of a heteroaromatic compound compared to its benzenoid counterpart. Results of theoretical calculations based on ab initio scheme are in good agreement with the experimental results.
引用
收藏
页码:6818 / 6825
页数:8
相关论文
共 22 条
[1]  
BOTTCHER CJF, 1973, THEORY ELECTRIC POLA, V1
[2]  
Canto A.F., 1987, NONLINEAR OPTICAL EL
[3]   EXPERIMENTAL INVESTIGATIONS OF ORGANIC MOLECULAR NONLINEAR OPTICAL POLARIZABILITIES .1. METHODS AND RESULTS ON BENZENE AND STILBENE DERIVATIVES [J].
CHENG, LT ;
TAM, W ;
STEVENSON, SH ;
MEREDITH, GR ;
RIKKEN, G ;
MARDER, SR .
JOURNAL OF PHYSICAL CHEMISTRY, 1991, 95 (26) :10631-10643
[4]   EXPERIMENTAL INVESTIGATIONS OF ORGANIC MOLECULAR NONLINEAR OPTICAL POLARIZABILITIES .2. A STUDY OF CONJUGATION DEPENDENCES [J].
CHENG, LT ;
TAM, W ;
MARDER, SR ;
STIEGMAN, AE ;
RIKKEN, G ;
SPANGLER, CW .
JOURNAL OF PHYSICAL CHEMISTRY, 1991, 95 (26) :10643-10652
[5]   ELECTRIC DIPOLE POLARIZABILITY OF ATOMS BY HARTREE-FOCK METHOD .I. THEORY FOR CLOSED-SHELL SYSTEMS [J].
COHEN, HD ;
ROOTHAAN, CC .
JOURNAL OF CHEMICAL PHYSICS, 1965, 43 (10) :S034-+
[6]   ATOMIC POLARIZABILITIES AND SHIELDING FACTORS [J].
DALGARNO, A .
ADVANCES IN PHYSICS, 1962, 11 (44) :281-315
[7]   GROUND-STATES OF MOLECULES .38. MNDO METHOD - APPROXIMATIONS AND PARAMETERS [J].
DEWAR, MJS ;
THIEL, W .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1977, 99 (15) :4899-4907
[8]   PARALLEL COMPUTATION OF MOLECULAR-ENERGY GRADIENTS ON THE LOOSELY COUPLED ARRAY OF PROCESSORS (LCAP) [J].
DUPUIS, M ;
WATTS, JD .
THEORETICA CHIMICA ACTA, 1987, 71 (2-3) :91-103
[9]  
DUPUIS M, HONDO 7 0
[10]   ABINITIO ANALYTIC POLARIZABILITY, 1ST-HYPERPOLARIZABILITY AND 2ND-HYPERPOLARIZABILITY OF LARGE CONJUGATED ORGANIC-MOLECULES - APPLICATIONS TO POLYENES C4H6 TO C22H24 [J].
HURST, GJB ;
DUPUIS, M ;
CLEMENTI, E .
JOURNAL OF CHEMICAL PHYSICS, 1988, 89 (01) :385-395