Spin-coupled calculations based on projected spin eigenfunctions

被引：2
|
作者：
Friis-Jensen, B
Cooper, DL
Rettrup, S
机构：
[1] Univ Copenhagen, Dept Chem, DK-2100 Copenhagen O, Denmark
[2] Univ Liverpool, Dept Chem, Liverpool L69 7ZD, Merseyside, England
来源：
THEORETICAL CHEMISTRY ACCOUNTS | 1998年 / 99卷 / 01期
关键词：
spin-coupled; projected spin eigenfunctions; symmetric group;
D O I：
10.1007/s002140050304
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：
It is outlined how the utilization of a basis of projected spin eigenfunctions can lead to increased computational efficiency in the evaluation of matrix elements and density matrices in spin-coupled valence bond calculations.
引用
收藏
页码：64 / 67
页数：4
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