OPTICAL-EXCITATION OF CO+-N-2

被引:26
作者
ASHER, RL
BELLERT, D
BUTHELEZI, T
BRUCAT, PJ
机构
[1] UNIV FLORIDA,DEPT CHEM,GAINESVILLE,FL 32611
[2] UNIV FLORIDA,DEPT CHEM PHYS,GAINESVILLE,FL 32611
关键词
D O I
10.1021/j100004a002
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 electrostatic complex of Co+ with a single N-2 molecule is studied by optical excitation of the metal ion. Vibrational structures of such electronic transitions show excited state progressions of the complex modes. A single far-red transition shows little geometry change upon excitation and displays the rotational contour of a nonlinear complex. Yellow transitions show vibrational structure indicative of a gross geometry change with progressions in both stretching and rocking modes. This suggests that CoN2+ possesses a ''T''-shaped ground state and both linear and nonlinear excited states. A particular linear upper state, the (B) over tilde state, is characterized vibrationally with a typical metal-ligand stretching frequency (140 cm(-1)) but a rather flaccid rocking frequency (14 cm(-1)). The geometry change upon 3d(7)4s <-- 3d(8) excitation of the Co+ ion in this complex is discussed in terms of a simple model potential which includes both electrostatic and inductive components.
引用
收藏
页码:1068 / 1072
页数:5
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