THEORETICAL-STUDY ON THE UNUSUAL EFFECT OF PHENYL SUBSTITUENT ON 2ND-ORDER HYPERPOLARIZABILITY

被引:5
作者
KODAKA, M
FUKAYA, T
YONEMOTO, K
SHIBUYA, I
机构
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D O I
10.1039/c39900001096
中图分类号
O6 [化学];
学科分类号
0703 ;
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页码:1096 / 1098
页数:3
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[1]  
CHEMLA DS, 1987, NONLINEAR OPTICAL PR, V1
[2]  
CHEMLA DS, 1987, NONLINEAR OPTICAL PR, V2
[3]  
DELBENE J, 1968, J CHEM PHYS, V48, P1807
[4]   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
[5]   THE DEVELOPMENT AND USE OF QUANTUM-MECHANICAL MOLECULAR-MODELS .76. AM1 - A NEW GENERAL-PURPOSE QUANTUM-MECHANICAL MOLECULAR-MODEL [J].
DEWAR, MJS ;
ZOEBISCH, EG ;
HEALY, EF ;
STEWART, JJP .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1985, 107 (13) :3902-3909
[6]  
HIRAI K, 1972, CHEM PHARM BULL, V20, P1711
[7]   ORIGIN OF THE NON-LINEAR 2ND-ORDER OPTICAL SUSCEPTIBILITIES OF ORGANIC-SYSTEMS [J].
LALAMA, SJ ;
GARITO, AF .
PHYSICAL REVIEW A, 1979, 20 (03) :1179-1194
[8]   2ND-ORDER HYPERPOLARIZABILITY OF PARA-NITROANILINE CALCULATED FROM PERTURBATION-THEORY BASED EXPRESSION USING CNDO-S GENERATED ELECTRONIC STATES [J].
MORRELL, JA ;
ALBRECHT, AC .
CHEMICAL PHYSICS LETTERS, 1979, 64 (01) :46-50
[9]   APPROXIMATE SELF-CONSISTENT MOLECULAR ORBITAL THEORY .4. CALCULATIONS ON MOLECULES INCLUDING ELEMENTS SODIUM THROUGH CHLORINE [J].
SANTRY, DP ;
SEGAL, GA .
JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (01) :158-&
[10]   CNDO CI CALCULATIONS ON SECOND-ROW MOLECULES .1. PHOSPHORIN AND THIOPHENE [J].
SCHULTE, KW ;
SCHWEIG, A .
THEORETICA CHIMICA ACTA, 1974, 33 (01) :19-28