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用准相对论Hartree-Fock方法对Nb XIII离子二电子激发组态3d94s2, 3d94s4p, 3d94p2 的能级结构做了全面系统的理论计算研究.在对已有研究结果分析的基础上, 运用最小二乘方法对径向积分参数进行了优化计算, 得到了与这些组态有关的电偶极允许跃迁的谱线波长和跃迁概率.计算结果与最新的实验值做了对比分析, 表明本文计算结果是准确的. 研究发现, 波长40.92 nm的谱线, 属于3d94s(1D)4p2F7/2–3d9 (2D)4s2 2D5/2 的跃迁谱线, 而不属于3d94s (1D)4p4D7/2–3d9(2D)4s2 2D5/2 的跃迁谱线, 即上谱项能级为2F7/2, 而不是4D7/2.Fine-structure energy levels of two-electron excitation configurations 3d94s2, 3d94s4p, 3d94p2 are calculated by Hartree-Fock method, which includes the configuration interaction, relativistic correction and approximate Breit correction, for copper-like Nb XIII. More accurate levels are obtained by the least-square-fit technique. The wavelengths and transition probabilities of 3d94s4p-3d104s, 3d94s2-3d104p, 3d94p2-3d104p, 3d94s4p-3d94s2 transition array are obtained, and some unknown results are predicted. Computing research shows that the 40.92 nm line should belong to 3d94s(1D)4p2F7/2-3d9(2D)4s2 2D5/2 transition, but not to the 3d94s(1D)4p4D7/2-3d9(2D)4s2 2D5/2 transition, and the upper term level should be 2F7/2, but not 4D7/2.







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