INVESTIGATION OF ELECTRONIC STRUCTURE OF TICL4

被引:44
作者
BECKER, CAL
BALLHAUS.CJ
TRABJERG, I
机构
[1] Department of Chemistry, The University of Copenhagen, Copenhagen Ø
来源
THEORETICA CHIMICA ACTA | 1969年 / 13卷 / 05期
关键词
D O I
10.1007/BF00527013
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 electronic absorption spectrum of gaseous TiCl4 over the range 4000-1100 Å is presented and discussed in light of extensive CNDO-MO calculations. From calculated transition energies and the variation of these energies with respect to small changes in Ti-Cl bond length a tentative assignment of the six-band spectrum is offered. © 1969 Springer-Verlag.
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页码:355 / &
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