Ionization potentials of the N2O molecule

被引：4

作者：

Pipano, A. ^{[1
]}

Kaufman, J. J. ^{[1
]}

机构：

[1] Johns Hopkins Univ, Dept Chem, Baltimore, MD 21218 USA

来源：

CHEMICAL PHYSICS LETTERS | 1970年 / 7卷 / 01期

关键词：

D O I：

10.1016/0009-2614(70)80258-5

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：

Minimal basis STO. SCF and CI calculations hove been made for the three lowest ionization potentials of N-N-O. Although lower ground state energies are obtained both in the Cl and SCF calculations when identical Slater orbitals. centered on different nitrogen atoms. have different exponents. the computed ionization potentials become better as those exponents are made equal.

引用

页码：99 / 101

页数：3

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