AB-INITIO INVESTIGATION OF THE GROUND-STATE POTENTIAL SURFACES OF HE-NO+ AND AR-NO+

被引:33
|
作者
ROBBE, JM [1 ]
BENCHEIKH, M [1 ]
FLAMENT, JP [1 ]
机构
[1] ECOLE POLYTECH,MECANISMES REACT LAB,F-91128 PALAISEAU,FRANCE
关键词
D O I
10.1016/0009-2614(93)89119-3
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
New experiments based on resonant multiphoton ionization spectroscopy have allowed the observation of Ar-NO and Ar-NO+ ground states. We present a new theoretical method, using a CIPSI approach, to calculate the ground state potential surfaces of X-NO+ complexes (X = He, Ar), which gives results in good agreement with experiment.
引用
收藏
页码:170 / 174
页数:5
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