PADE-APPROXIMANT REPRESENTATION AND IMPROVEMENT OF EMPIRICAL POTENTIALS OF DIATOMIC-MOLECULES

被引：15

作者：

JORISH, VS

SHCHERBAK, NB

机构：

[1] Chemical Thermodynamics Department, Institute for High Temperature, USSR Academy of Sciences

来源：

CHEMICAL PHYSICS LETTERS | 1979年 / 67卷 / 01期

关键词：

D O I：

10.1016/0009-2614(79)87128-6

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：

A morse potential is used as a test to check up the accuracy of the two-point Pad{approaches the limit}-approximant (PA) representation for the potential curves of diatomic molecules. An exact PA representation of the Mg2 potential is obtained. © 1979.

引用

页码：160 / 164

页数：5

共 15 条

[11] Long-range analysis of the internuclear potential of Mg-2 [J].