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Theoretical studies of the spin-Hamiltonian parameters and defect structure for the tetragonal Gd(3+) center in cubic c-RbZnF(3) crystal

文献类型:期刊论文

作者W. C. Zheng ; W. Q. Yang ; H. G. Liu
刊名Philosophical Magazine
出版日期2011
卷号91期号:31页码:4045-4052
关键词crystal field defect structure electron paramagnetic resonance c-RbZnF(3) Gd(3+) electron-paramagnetic-resonance superposition-model analysis single-crystals perovskite fluorides field parameters epr-spectra state luminescence kmgf3 ions
ISSN号1478-6435
中文摘要A diagonalization (of the energy matrix for which the Hamiltonian contains the free ion, crystal-field interaction and Zeeman interaction terms) method was applied to calculate the spin-Hamiltonian parameters (g factors, g(parallel to) and g(perpendicular to), and five zero-field splittings, b(m)(n)) for the tetragonal Gd(3+) center in cubic c-RbZnF(3) perovskite. The calculated results are in reasonable agreement with experimental values. From the calculation, the defect model that the tetragonal Gd(3+) center is attributed to Gd(3+) occupying the 12-fold coordinated Rb(+) site associated with a nearest Rb(+) vacancy, V(Rb), along C(4) axis owing to charge compensation is confirmed and the defect structural data of this Gd(3+) impurity center in c-RbZnF(3) are acquired. The results are discussed.
原文出处://WOS:000298584500006
公开日期2012-04-13
源URL[http://210.72.142.130/handle/321006/30974]  
专题金属研究所_中国科学院金属研究所
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W. C. Zheng,W. Q. Yang,H. G. Liu. Theoretical studies of the spin-Hamiltonian parameters and defect structure for the tetragonal Gd(3+) center in cubic c-RbZnF(3) crystal[J]. Philosophical Magazine,2011,91(31):4045-4052.
APA W. C. Zheng,W. Q. Yang,&H. G. Liu.(2011).Theoretical studies of the spin-Hamiltonian parameters and defect structure for the tetragonal Gd(3+) center in cubic c-RbZnF(3) crystal.Philosophical Magazine,91(31),4045-4052.
MLA W. C. Zheng,et al."Theoretical studies of the spin-Hamiltonian parameters and defect structure for the tetragonal Gd(3+) center in cubic c-RbZnF(3) crystal".Philosophical Magazine 91.31(2011):4045-4052.

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来源:金属研究所

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