On the Calculation of Two-Center Overlap Integrals with STO's Using Zeta-Function Method and Multipole Moments期刊界 All Journals 搜尽天下杂志传播学术成果专业期刊搜索期刊信息化学术搜索

On the Calculation of Two-Center Overlap Integrals with STO's Using Zeta-Function Method and Multipole Moments

Authors:	Naci Sünel

Affiliation:	(1) Department of Physics, Gaziosmanpasa University, 60240 Tokat, Turkey

Abstract:	One electron two-center overlap integrals are re-derived using Barnett's -function method and Guseinov electric-multipole-moments translation technique. To evaluate these integrals a computer program has been constructed. The obtained results are in good agreement with literature.

Keywords:	STO orbitals /content/n4057r3323v25245/xxlarge950.gif" alt=" zeta" align=" MIDDLE" BORDER=" 0" >-functions one-electron overlap integrals
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