Theoretical Investigations on the Spin Hamiltonian Parameters and Local Structure for the Tetragonal Pt3+ Center in BaTiO3
文献类型:期刊论文
作者 | Z. H. Zhang ; S. Y. Wu ; B. T. Song ; S. X. Zhang |
刊名 | Brazilian Journal of Physics
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出版日期 | 2012 |
卷号 | 42期号:5-6页码:340-346 |
关键词 | Impurity and defects Electron paramagnetic resonance Pt3+ BaTiO3 electron-paramagnetic-resonance atomic screening constants doped batio3 superposition model magnetic-resonance single-crystals scf functions thin-films ceramics ions |
ISSN号 | 0103-9733 |
中文摘要 | The spin Hamiltonian parameters (g factors and the hyperfine structure constants) and the local structure for the tetragonal Pt (3 +) center in BaTiO (3) are theoretically investigated from the improved perturbation formulas of these parameters for a 5d (7) ion in a tetragonally elongated octahedron. The Jahn-Teller effect yields 0.05 longer Pt (3 +) -aEuro parts per thousand O (2 -aEuro parts per thousand) bonds along the C (4) axis. Under the uniaxial [001] stress of 0.17GPa, the impurity center shows a moderate decrease of 12% for the tetragonal elongation and a slight increase of 3% for the core polarization constant, leading to the decline of the anisotropy Delta g (= g (aSyenaEuro parts per thousand) -aEuro parts per thousand g (//)) and the increase of Delta A (= A (aSyenaEuro parts per thousand) -aEuro parts per thousand A (//)), respectively. The calculated spin Hamiltonian parameters show good agreement with the observed values. |
原文出处 | |
公开日期 | 2013-02-05 |
源URL | [http://ir.imr.ac.cn/handle/321006/60471] ![]() |
专题 | 金属研究所_中国科学院金属研究所 |
推荐引用方式 GB/T 7714 | Z. H. Zhang,S. Y. Wu,B. T. Song,et al. Theoretical Investigations on the Spin Hamiltonian Parameters and Local Structure for the Tetragonal Pt3+ Center in BaTiO3[J]. Brazilian Journal of Physics,2012,42(5-6):340-346. |
APA | Z. H. Zhang,S. Y. Wu,B. T. Song,&S. X. Zhang.(2012).Theoretical Investigations on the Spin Hamiltonian Parameters and Local Structure for the Tetragonal Pt3+ Center in BaTiO3.Brazilian Journal of Physics,42(5-6),340-346. |
MLA | Z. H. Zhang,et al."Theoretical Investigations on the Spin Hamiltonian Parameters and Local Structure for the Tetragonal Pt3+ Center in BaTiO3".Brazilian Journal of Physics 42.5-6(2012):340-346. |
入库方式: OAI收割
来源:金属研究所
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