Vibration-rotation emission spectra and combined isotopomer analyses for the coinage metal hydrides: CuH & CuD, AgH & AgD, and AuH & AuD

被引:78
作者
Seto, JY [1 ]
Morbi, Z [1 ]
Charron, F [1 ]
Lee, SK [1 ]
Bernath, PF [1 ]
Le Roy, RJ [1 ]
机构
[1] Univ Waterloo, Guelph Waterloo Ctr Grad Work Chem & Biochem, Waterloo, ON N2L 3G1, Canada
关键词
D O I
10.1063/1.479120
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
High resolution infrared emission spectra have been measured for AuH and AuD and for two isotopomers of each of CuH, CuD, AgH, and AgD. The molecules were made in a carbon tube furnace (King furnace), and in spite of intense background thermal emission from the furnace (at > 2000 degrees C), vibration-rotation emission data could be recorded. Together with high resolution measurements taken from the literature, the data for each species were treated using two types of combined-isotopomer analysis: One based on fits to empirical molecular parameters, and the other based on direct fits to the underlying potential energy functions, both of which take account of mass-dependent Born-Oppenheimer breakdown correction terms. Accurate isotopically related Dunham parameters and Born-Oppenheimer breakdown parameters are obtained for each species, as well as accurate analytic potential functions and adiabatic and nonadiabatic radial correction functions. (C) 1999 American Institute of Physics. [S0021-9606(99)02224-2].
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页码:11756 / 11767
页数:12
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