Calculation of the differential photoionization cross section of HF

被引:9
作者
Cacelli, I [1 ]
Carravetta, V [1 ]
机构
[1] CNR,IST CHIM QUANTIST & ENERGET MOLEC,I-56100 PISA,ITALY
关键词
D O I
10.1016/0301-0104(95)00387-8
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
Cross sections, photoelectron angular distribution parameters and branching ratios for the ionization of the valence 1 pi, 3 sigma and inner-valence 2 sigma shells of hydrogen fluoride have been calculated in the Random Phase Approximation (RPA). The computational procedure is based on the K-matrix technique and projection on basis sets of L(2) functions to solve the RPA equations for the three coupled ionization channels in a way that recovers the electronic continuum degeneracy.
引用
收藏
页码:89 / 98
页数:10
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