COMPARATIVE-STUDY OF THE DISSOCIATION-ENERGIES OF NI2 AND NI2+

被引：24

作者：

BAUSCHLICHER, CW

PARTRIDGE, H

LANGHOFF, SR

机构：

[1] NASA Ames Research Center, Moffett Field

来源：

CHEMICAL PHYSICS LETTERS | 1992年 / 195卷 / 04期

关键词：

D O I：

10.1016/0009-2614(92)85617-J

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：

Computations at the internally contracted averaged coupled-pair-functional level of theory yield a dissociation energy (D0) for Ni2+ that is 0.17 eV larger than that of Ni2. This finding is consistent with the collision-induced dissociation experiments of Lian, Su, and Armentrout, but rules out the results from the resonant two-photon dissociation experiments of Lessen and Brucat, which predict that the D0 value of Ni2+ is about 1 eV larger than that of Ni2.

引用

页码：360 / 364

页数：5

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