Dataset of Theoretical estimations of equilibrium and kinetic uranium isotope fractionations

The research data includes vibrational frequencies for the calculation of conventional mass-dependent fractionation factors and |Ψ(0)2| for the calculation of fractionation factors caused by nuclear volume effects of U-bearing species.

本研究数据集包含用于计算常规质量依赖分馏因子（conventional mass-dependent fractionation factors）的振动频率（vibrational frequencies），以及用于计算含铀物种（U-bearing species）核体积效应（nuclear volume effects）所引发分馏因子的|Ψ(0)|²。