DETERMINATION OF ATOMIC POINT CHARGES AND POINT DIPOLES FROM THE CARTESIAN DERIVATIVES OF THE MOLECULAR DIPOLE-MOMENT AND 2ND MOMENTS, AND FROM ENERGY 2ND DERIVATIVES OF PLANAR DIMERS .1. THEORY

被引：104

作者：

DINUR, U ^{[1
]}

HAGLER, AT ^{[1
]}

机构：

[1] AGOURON INST,LA JOLLA,CA 92037

来源：

JOURNAL OF CHEMICAL PHYSICS | 1989年 / 91卷 / 05期

关键词：

D O I：

10.1063/1.456965

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：

引用

页码：2949 / 2959

页数：11

共 51 条

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