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中国物理学会期刊

掺入Ni元素的LiCoO2晶体光谱结构及电子顺磁共振g因子

CSTR: 32037.14.aps.55.1991

Spectrum structure and g factor of electron paramagnetic resonance of LiCoO2 crystal doped with Ni

CSTR: 32037.14.aps.55.1991
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  • 在弱场图像下,利用Racah不可约张量算符方法得到了三角对称3d4/3d6电子组态的210阶可完全对角化的微扰哈密顿矩阵、最近邻点电荷模型晶体结构常量公 式和电子顺磁共振g因子公式.研究了LiCoO2晶体和掺入Ni的LiCoO2 :Ni晶体中Co3+的基态能级、晶体结构和电子顺磁共振g因子.考虑了LiCoO 2晶体和LiCoO2:Ni晶体中自旋单重态和

     

    In the weak field scheme, the complete diagonalizing Hamiltonian matrices and th e constants of crystal structure and g factor of electron paramagnetic resonanc e are derived for 3d4/3d6 ions configuration in the trigon al symmetry in terms of Racahs irreducible tensor operator method. The ground- state energy levels and the constants of crystal structure and g factor of elec tron paramagnetic resonance of the Co3+ in LiCoO2 and LiCo O2:Ni crystals are studied. The spin singlets and triplet of the grou nd-state energy levels of the Co3+ in LiCoO2 and LiCoO2:Ni crystals are taken into consideration in the calculation and applica tion of the crystal-field energy of 3d4/3d6. The changes o f the constants of local structure, which are the causes of the changes of the g round-state energy levels of the Co3+, and the values of g factor of electron paramagnetic resonance of Co3+ in LiCoO2 and LiCo O2:Ni crystals are also studied. The theoretical results are in good agreement with the experimental observations.

     

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