Exact quantum mechanical kinetic energy operator in valence coordinates for internal motions of a polyatomic molecule

被引：26
作者：
Makarewicz, J [1 ]
Skalozub, A [1 ]
机构：
[1] Adam Mickiewicz Univ, Fac Chem, PL-60780 Poznan, Poland
来源：
CHEMICAL PHYSICS LETTERS | 1999年 / 306卷 / 5-6期
关键词：
D O I：
10.1016/S0009-2614(99)00466-2
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：
The exact quantum mechanical kinetic energy operator describing internal motions of a polyatomic molecule in valence internal coordinates is presented. It is written in the standard normalization convention in which it contains a small number of linear differential terms of simple and uniform structure, independent of the specific structure of the molecule. (C) 1999 Elsevier Science B.V. All rights reserved.
引用
收藏
页码：352 / 356
页数：5
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