Theoretical calculation of EPR g factors for Ni3+ ion at the interstitial site of SnO2 crystal

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	Theoretical calculation of EPR g factors for Ni3+ ion at the interstitial site of SnO2 crystal
	L. He; X. X. Wu; H. G. Liu; W. C. Zheng
	2007
发表期刊	Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy
ISSN	1386-1425
卷号	68 期号:3 页码:891-893
摘要	The EPR g factors g(x), g(y) and g(z) for Ni3+ ion at the interstitial site in the rutile-type SnO2 crystal are calculated from the second-order perturbation formulas of g factors based on the cluster approach for 3d(7) ion in rhombic symmetry. The calculated results are in agreement with the experimental values. The local lattice distortion induced by the impurity Ni3+ at the interstitial site of SnO2 is also estimated from the calculations. These results are discussed. (C) 2007 Elsevier B.V. All rights reserved.
部门归属	sichuan univ, dept mat sci, chengdu 610064, peoples r china. civil aviat flying inst china, dept phys, guanghan 618307, peoples r china. zhejiang normal univ, coll math phys & informat engn, jinhua 321004, peoples r china. chinese acad sci, int ctr mat phys, shenyang 110016, peoples r china.;zheng, wc (reprint author), sichuan univ, dept mat sci, chengdu 610064, peoples r china;zhengwc1@163.com
关键词	Electron Paramagnetic Resonance Crystal And ligAnd-field Theory Defect Structure Ni3++ Sno2 Atomic Screening Constants Scf Functions System Impurities Oxide Cr3++ Nanocrystals Parameters Electrons Rutile
URL	查看原文
WOS记录号	WOS:000250607900074
引用统计	被引频次：7[WOS] [WOS记录] [WOS相关记录]
文献类型	期刊论文
条目标识符	http://ir.imr.ac.cn/handle/321006/33571
专题	中国科学院金属研究所
推荐引用方式 GB/T 7714	L. He,X. X. Wu,H. G. Liu,et al. Theoretical calculation of EPR g factors for Ni3+ ion at the interstitial site of SnO2 crystal[J]. Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy,2007,68(3):891-893.
APA	L. He,X. X. Wu,H. G. Liu,&W. C. Zheng.(2007).Theoretical calculation of EPR g factors for Ni3+ ion at the interstitial site of SnO2 crystal.Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy,68(3),891-893.
MLA	L. He,et al."Theoretical calculation of EPR g factors for Ni3+ ion at the interstitial site of SnO2 crystal".Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy 68.3(2007):891-893.