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Theoretical studies of lattice distortions around the impurity ions in V2+ doped CdCl2, CdI2 and PbI2

文献类型:期刊论文

作者S. Y. Wu ; X. Y. Gao ; H. N. Dong
刊名Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy
出版日期2006
卷号63期号:3页码:754-758
关键词electron paramagnetic resonance MX2 (M = Cd X = Cl impurity structures Pb I) crystal-fields and spin hamiltonians V2+ electron-paramagnetic-resonance superposition model cadmium chloride cr3+ ions crystals spectroscopy absorption mn co
ISSN号1386-1425
中文摘要The lattice distortions around the impurity ions in V2+ doped CdCl2. Cdl(2) and PbI2 are theoretically studied from the perturbation formulas of the spin Hamiltonian (SH) parameters zero-field splitting, g factors and the hyperfine structure constants for a 3d(3) ion in trigonal symmetry based on the cluster approach. In these formulas, the contributions from the s-orbitals of the ligands are taken into account. Based on the studies, it is found that the local angles beta (between the impurity-ligand bonding lengths and the C-3 axis) in the impurity centers are smaller than the angles beta(H) in the hosts. The calculated SH parameters based on the above local angles beta show better agreement than those on neglecting of the ligand s-orbital contributions (and those on the host angles beta(H)) with the experimental data, (c) 2005 Elsevier B.V. All rights reserved.
原文出处://WOS:000235637000035
公开日期2012-04-14
源URL[http://ir.imr.ac.cn/handle/321006/34578]  
专题金属研究所_中国科学院金属研究所
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S. Y. Wu,X. Y. Gao,H. N. Dong. Theoretical studies of lattice distortions around the impurity ions in V2+ doped CdCl2, CdI2 and PbI2[J]. Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy,2006,63(3):754-758.
APA S. Y. Wu,X. Y. Gao,&H. N. Dong.(2006).Theoretical studies of lattice distortions around the impurity ions in V2+ doped CdCl2, CdI2 and PbI2.Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy,63(3),754-758.
MLA S. Y. Wu,et al."Theoretical studies of lattice distortions around the impurity ions in V2+ doped CdCl2, CdI2 and PbI2".Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy 63.3(2006):754-758.

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来源:金属研究所

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