SPIN-ORBIT-COUPLING IN MOLECULAR AUGER-SPECTRA - PROPENSITY RULES TESTED FOR WATER

被引:13
作者
AGREN, H
VAHTRAS, O
机构
[1] Institute of Physics and Measurement Technology, University of Linkoping, Linkoping
关键词
D O I
10.1088/0953-4075/26/5/014
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
Electronic spectra of dicationic molecules comprise a high density of singlet and triplet states. By virtue of simple propensity rules only the singlet states are selected by core-valence (CVV) Auger spectroscopy. We use second-order response theory to explore the role of spin-orbit interaction in the manifold of low-lying dicationic states and its implications on the intensity analysis of the Auger spectrum of water.
引用
收藏
页码:913 / 919
页数:7
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