IONIZATION ENERGIES OF Y-N (N=1-4)

被引：14

作者：

DAI, DG

BALASUBRAMANIAN, K

机构：

[1] Department of Chemistry, Arizona State University, Tempe

来源：

CHEMICAL PHYSICS LETTERS | 1995年 / 238卷 / 1-3期

关键词：

D O I：

10.1016/0009-2614(95)00376-2

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：

We have studied the vertical ionization energies of yttrium clusters using complete active space multi-configuration followed by multi-reference configuration interaction calculations which included 2.7 million configurations. The computed ionization energies and the overall trend for the ionization potentials as a function of cluster size agree with the recent photoionization spectra of yttrium clusters reported by Knickelbein.

引用

页码：203 / 207

页数：5

共 25 条

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