α-Al2O3中三角Ru3+中心的g因子研究

An Investigation of the g Factors of the Trigonal Ru3+ Centers in α-Al2O3

  • 摘要: 基于晶体场模型,采用三角对称下4d5离子各向异性g因子微扰公式,对α-Al2O3中三角Ru3+中心的电子顺磁共振实验结果进行了理论研究。计算中利用较新的Ru3+自由离子旋轨耦合参数,考虑了轨道缩小因子和旋轨耦合参数对杂质Ru3+中心g因子的影响,讨论了Ru3+中心的局部结构性质,结果表明理论与实验符合得很好。

     

    Abstract: Based on the crystal-field theory, the anisotropic g factors of the trigonal Ru3+ center in α-Al2O3 are theoretically studied by using the perturbation formulas of the g factors for a 4d5 ion in trigonal symmetry. In these formulas, the orbital reduction factor k and the spin-orbit coupling parameter ζd for the impurity Ru3+ in the crystal as well as their contributions to the g factors are taken into account in a uniform way. The calculated results show good agreement with the experimental data. In addition, the local structure property of the impurity center is also discussed.

     

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