Symmetry-adapted algebraic description of stretching and bending vibrations of ozone

被引:38
|
作者
PerezBernal, F
Arias, JM
Frank, A
Lemus, R
Bijker, R
机构
[1] UNIV NACL AUTONOMA MEXICO,INST CIENCIAS NUCL,MEXICO CITY 04510,DF,MEXICO
[2] INST FIS,LAB CUERNAVACA,CUERNAVACA,MORELOS,MEXICO
关键词
D O I
10.1006/jmsp.1997.7296
中图分类号
O64 [物理化学(理论化学)、化学物理学]; O56 [分子物理学、原子物理学];
学科分类号
070203 ; 070304 ; 081704 ; 1406 ;
摘要
The vibrational excitations of ozone, including both bending and stretching vibrations, are studied in the framework of a symmetry-adapted algebraic approach. This method is based on the isomorphism between the U(2) algebra and the one-dimensional Morse oscillator, and the introduction of point group symmetry techniques. The use of symmetry-adapted interactions, which in the harmonic limit have a clear physical interpretation, makes it possible to systematically include higher-order terms and anharmonicities. A least-squares fit to all published experimental levels (up to 10 quanta)of O-16(3) and O-18(3) yields rms deviations of 2.5 and 1.0 cm(-1), respectively. (C) 1997 Academic Press.
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页码:1 / 11
页数:11
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