THEORETICAL RADIATIVE LIFETIMES IN NO+(X1-SIGMA+)

被引:27
作者
CHAMBAUD, G [1 ]
ROSMUS, P [1 ]
机构
[1] UNIV FRANKFURT,FACHBEREICH CHEM,W-6000 FRANKFURT,GERMANY
关键词
D O I
10.1016/0009-2614(90)85454-K
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
Potential energy and dipole moment functions for the electronic ground state of the NO+ ion have been calculated from highly correlated CASSCF-CI electronic wavefunctions. The radiative lifetimes of the vibrational states are compared with two different experimental measurements and previous theoretical data. The CASSCF-CI lifetimes are: 88, 45, 31, 24, 20 and 17 (for v=1 to 6; all values in ms). © 1990.
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页码:429 / 431
页数:3
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