Calculations of molecular constants for the ground electronic states of alkali metal dimers based on combined potential energy curves

被引:0
|
作者
Smirnov, AD [1 ]
机构
[1] Moscow State Tech Univ, Moscow 107005, Russia
来源
RUSSIAN JOURNAL OF PHYSICAL CHEMISTRY | 2002年 / 76卷 / 02期
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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
Potential energy curves were constructed for the ground electronic states of alkali metal dimers in a wide range of internuclear distance variations. Each curve was a combination of three potential functions (the perturbed Morse oscillator, Rydberg-Klein-Ries, and van der Waals functions), which well approximated different portions of real diatomic molecule potentials. These potential curves were used to calculate molecular constants. The results were compared with those obtained from the experimental data.
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页码:224 / 230
页数:7
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