A new interpretation of the CrO- photoelectron detachment spectra

被引：11

作者：

Bauschlicher, CW

Gutsev, GL

机构：

[1] NASA, Ames Res Ctr, Space Technol Div, Moffett Field, CA 94035 USA

[2] Univ Virginia, Dept Chem, Charlottesville, VA 22901 USA

来源：

JOURNAL OF CHEMICAL PHYSICS | 2002年 / 116卷 / 09期

关键词：

D O I：

10.1063/1.1448829

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：

Complete active space self-consistent field/multireference configuration interaction calculations are performed on CrO- and CrO. The ground state of CrO- is identified as (4)Pi, not (6)Sigma(+), as recently suggested. We assign the experimental detachment features to the seven one-electron processes arising from the two ion states. (C) 2002 American Institute of Physics.

引用

页码：3659 / 3661

页数：3

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