MOLECULAR VIBRATIONS OF COMPLEXES WITH TRIGONAL LIGANDS .10. T MODEL OF ZR(BH4)4 WITH CALCULATED MEAN AMPLITUDES

被引:7
作者
CYVIN, BN [1 ]
CYVIN, SJ [1 ]
WHITMER, JC [1 ]
机构
[1] WESTERN WASHINGTON STATE COLL,DEPT CHEM,BELLINGHAM,WA 98225
关键词
D O I
10.1016/0022-2860(79)80350-6
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
A normal coordinate analysis of Zr(BH4)4 was performed on the basis of a T model for the molecule. The shifts in mean amplitudes when passing from Td to T are discussed. The force field was refined by means of the latest vibrational spectroscopic data from the literature, and the complete sets of mean amplitudes and perpendicular amplitude correction coefficients are given. The refined force field was finally applied to the Zr(BD4)4 isotopic molecule. © 1979.
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收藏
页码:281 / 286
页数:6
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