Dissociation energy of the molecule ZnI

被引:5
|
作者
Hildenbrand, DL [1 ]
Lau, KH [1 ]
机构
[1] SRI Int, Menlo Pk, CA 94025 USA
关键词
D O I
10.1016/j.cplett.2003.07.022
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 dissociation energy (D-0(0)) of the molecule ZnI was determined from gaseous equilibrium measurements over the range 993-1058 K. The Ag-Zn-I chemical species were generated by reaction Of I-2(g) with a Ag/Zn/Cu sample in an effusion cell source, and their abundances were monitored by mass spectrometry. Both the resulting D-0(0)(ZnI) = 35.7 +/- 1.5 kcal mol(-1) and a previously reported equilibrium value for D-0(0)(ZnCl) are somewhat larger than reported theoretical values, with the Gaussian MP2 method yielding D-0(0) values in closest agreement with experiment. (C) 2003 Elsevier B.V. All rights reserved.
引用
收藏
页码:37 / 39
页数:3
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