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Symmetry of Internal Dynamics and Separation of Motions in the Major Isomer of the LiReO_(4) Molecule

机译:LiReO_(4)分子主要异构体的内部动力学对称性和运动分离

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摘要

The internal dynamics of the major isomer of the LiReO_(4) molecule, with account taken of the torsional transitions of the Li~(+) cation between its six energetically equivalent equilibrium positions relative to the ReO_(4)~(-) anion, is analyzed in terms of symmetry-group chain methods. On this basis, the problem of separation of torsional and rotational motions, which is a nontrivial problem in this case, is solved and a rigorous model for the description of the energy spectrum in an arbitrary vibronic state is constructed.
机译:考虑到Li〜(+)阳离子相对于ReO_(4)〜(-)阴离子的六个能量等效平衡位置之间的扭转跃迁,LiReO_(4)分子主要异构体的内部动力学,根据对称组链方法进行分析。在此基础上,解决了扭转运动和旋转运动分离的问题,在这种情况下这是不平凡的问题,并构建了用于描述任意振动状态下能谱的严格模型。

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