Calculation of Two-center Nuclear Attraction Integrals over Slater Type Orbitals in Molecular Coordinate System

被引：0
|
作者：
MAMEDOV
B.A.
机构：
[1] Department of Physics
[2] Faculty of Arts and Sciences
[3] Gaziosmanpasa University
[4] Tokat
[5] Turkey
来源：
Chinese Journal of Chemistry | 2004年 / 06期
关键词：
Slater type orbitals; nuclear attraction integrals; overlap integrals; molecular integrals;
D O I：
暂无
中图分类号：
O641 [结构化学];
学科分类号：
070304 ; 081704 ;
摘要：
A closed analytical relation is derived for the two-center nuclear attraction integrals over Slater type orbitals (STOs) in terms of binomial coefficients. This formula can be used in highly accurate calculations of the nuclear at-traction integrals. The relationships obtained are valid for arbitrary values of quantum numbers and screening con-stants of STOs and location of nuclei.
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页码：545 / 548 +501
页数：5
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