三原子分子
粘结长度
弯曲分子几何
分子
基态
激发态
从头算
离子键合
化学
原子物理学
从头算量子化学方法
分子物理学
分子几何学
计算化学
结晶学
离子
物理
有机化学
作者
D. Bellert,W. H. Breckenridge
摘要
The short bond length of the linear ground state of the 7Li16O7Li molecule has been accurately determined to be 1.606±0.008 Å by analysis of the rotational structure of several bands assigned to transitions from the jet-cooled 1Σ+ vibronic ground state to a bent 1B1 excited state. This value is in good agreement with, but more accurate than, other experimental and ab initio bond-length estimates for the prototypical ionically bound triatomic molecule Li+O−2Li+.
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