用密度泛函方法计算了复合物的基态结构、振动频率和电子跃迁能。
Density functional theory calculations were carried out to examine the structure and normal mode frequencies of the ground state of the complex and its electronic transition energies.
基态磁矩的结果也很符合实验，我们也还计算了某些低能级之间的E2跃迁几率及分支比。
The agreement with experiment is fair. The ground state magnetic moments and reduced E2 transition probabilities between some low-lying states are also calculated.
铯133原子发射一个细的微波谱线当它的第55个电子从受激态轨道跳回基态时(跃迁)。
Cesium-133 atoms emit a thin microwave spectral line when its 55th electron jumps back from an excited state orbital to its ground state (transition).
应用推荐