Mid- and near-IR electronic absorption spectrum of CoO isolated in solid neon. Vibronic data for low-lying electronic states

被引:34
作者
Danset, D [1 ]
Manceron, L [1 ]
机构
[1] Univ Paris 06, CNRS, UMR 7075, LADIR Spectrochim Mol, F-75252 Paris, France
关键词
D O I
10.1021/jp0357626
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 optical absorption spectrum of cobalt monoxide generated by reaction of cobalt atoms and oxygen molecules in solid neon at 4 K has been reinvestigated. New data relative to four low-lying electronic states at 0.42, 0.73, 0.87, and 1.26 eV have been obtained in the mid- to near-IR region, each displaying vibronic structure. If assignment of the second low-lying electronic state to A(4)Pi(7/2) can be made clearly following previous gas-phase results, assignments of the first, third, and fourth electronic states to B(4)Sigma, a(6)Delta and b(2)Delta are tentative and suggested in comparison with existing quantum chemical calculations. For all states vibrational frequencies have been measured and an empirical correlation between CoO bond force constant and internuclear distance, using Herschbach and Laurie's relationship, is proposed.
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收藏
页码:11324 / 11330
页数:7
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