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EPR g factors and tetragonal distortion for the isoelectronic Ni(+) and Cu(2+) centers in the CuGaSe(2) crystal
W. L. Feng; X. M. Li; W. C. Zheng; Y. G. Yang; W. Q. Yang
2011
发表期刊Journal of Magnetism and Magnetic Materials
ISSN0304-8853
卷号323期号:5页码:528-531
摘要The EPR g factors, g(parallel to) and g(perpendicular to), for the isoelectronic 3d(9) ions Ni(+) and Cu(2+) at the tetragonal Cu(+) site of the CuGaSe(2) crystal are calculated from the high-order perturbation formulas based on a two-spin-orbit-parameter model. In the model, both the contributions to g factors from the spin-orbit parameter of central 3d(9) ion and that of ligand ion are contained. The calculated results appear to be consistent with the experimental values. The tetragonal distortions (characterized by theta - theta(0), where theta is the angle between the metal-ligand bond and C(4) axis, and theta(0)approximate to E54.74 degrees is the same angle in cubic symmetry) of Ni(+) and Cu(2+) centers, which are different from the corresponding angle in the host CuGaSe(2) crystal and from impurity to impurity, are obtained from the calculations. The difference of the sign of g(parallel to) - g(perpendicular to) between the isoelectronic Ni(+) and Cu(2+) centers is found to be due to the different tetragonal distortions of both centers in the CuGaSe(2) crystal. (C) 2010 Elsevier B.V. All rights reserved.
部门归属[feng, w. l.; li, x. m.] chongqing univ, coll optoelect engn, minist educ, key lab optoelect technol & syst, chongqing 400044, peoples r china. [zheng, w. c.; yang, y. g.] sichuan univ, dept mat sci, chengdu 610064, peoples r china. [feng, w. l.] chongqing univ technol, dept appl phys, chongqing 400054, peoples r china. [yang, w. q.] chengdu univ informat & technol, dept opt & elect, chengdu 610225, peoples r china. [feng, w. l.; zheng, w. c.] chinese acad sci, int ctr mat phys, shenyang 110016, peoples r china.;feng, wl (reprint author), chongqing univ, coll optoelect engn, minist educ, key lab optoelect technol & syst, chongqing 400044, peoples r china;wenlinfeng@126.com xuemingli@cqut.edu.cn
关键词Electron Paramagnetic Resonance Crystal- And ligAnd-field Theory Defect Structure Ni(+) Cu(2+) Cugase(2) Electron-paramagnetic-resonance Atomic Screening Constants Solar-cells Defect Structures Scf Functions Thin-films Ions Transition Parameters Spectra
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文献类型期刊论文
条目标识符http://ir.imr.ac.cn/handle/321006/30324
专题中国科学院金属研究所
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GB/T 7714
W. L. Feng,X. M. Li,W. C. Zheng,et al. EPR g factors and tetragonal distortion for the isoelectronic Ni(+) and Cu(2+) centers in the CuGaSe(2) crystal[J]. Journal of Magnetism and Magnetic Materials,2011,323(5):528-531.
APA W. L. Feng,X. M. Li,W. C. Zheng,Y. G. Yang,&W. Q. Yang.(2011).EPR g factors and tetragonal distortion for the isoelectronic Ni(+) and Cu(2+) centers in the CuGaSe(2) crystal.Journal of Magnetism and Magnetic Materials,323(5),528-531.
MLA W. L. Feng,et al."EPR g factors and tetragonal distortion for the isoelectronic Ni(+) and Cu(2+) centers in the CuGaSe(2) crystal".Journal of Magnetism and Magnetic Materials 323.5(2011):528-531.
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