CORRELATION DIAGRAMS FOR HUND COUPLING CASES IN DIATOMIC-MOLECULES WITH HIGH ROTATIONAL ANGULAR-MOMENTUM

被引:26
作者
NIKITIN, EE [1 ]
ZARE, RN [1 ]
机构
[1] STANFORD UNIV,DEPT CHEM,STANFORD,CA 94305
基金
美国国家科学基金会;
关键词
D O I
10.1080/00268979400100074
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
A diatomic molecule has in general three angular momenta: electronic orbital angular momentum L, electronic spin angular momentum S, and nuclear rotation angular momentum R. They couple together to form the total angular momentum J. Nuclear spin angular momentum I, if present, usually couples to J to form F, but this coupling is ignored in this paper. In general, L, S, and R are not conserved, whereas J is. We consider the limit J >> L, S, where angular momentum addition can be treated semiclassically. We present correlation diagrams that connect five limiting coupling cases (Hund's cases (a)-(e)) for a given value of J at a fixed internuclear separation r. The results pertain to bound states of a molecule as well as to two atoms 'in collision'.
引用
收藏
页码:85 / 100
页数:16
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