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Theoretical studies of the optical and EPR spectra for Fe3+ ion in the MF3:Fe3+ (M = Al, Ga) systems
Li Ju-Fen1; Kuang Xiao-Yu2,3; Mao Ai-Jie2
Corresponding AuthorLi Ju-Fen(scu_ljf@163.com)
2010-03-01
Source PublicationJOURNAL OF LUMINESCENCE
ISSN0022-2313
Volume130Issue:3Pages:451-454
AbstractBy analyzing the EPR spectra of Fe3+ ion in the fluorinde glasses, the local lattice structures around impurity Fe3+ ion in MF3:Fe3+ (M = Al, Ga) systems have been studied by means of diagonalizing the complete energy matrices of the electron-electron repulsion, the ligand-field and the spin-orbit coupling for a d(5) configuration ion in a trigonal ligand-field. Both the second-order and fourth-order EPR parameters D and (a-F) are taken simultaneously in the structural investigation. The results indicate that the local lattice structure around octahedral Fe3+ center has an expansion distortion for Fe3+ in MF3:Fe3+ (M = Al, Ga). The expansion distortion may be ascribed to the fact that the radius of Fe3+ ion is larger than that of Al3+ ion and Ga3+ ion, and the Fe3+ ion will push the fluoride ligands upwards and downwards, respectively. The local lattice structure parameters R = 1.927 A, theta = 55.538 degrees for Fe3+ in AlF3:Fe3+ and R=1.931 A, theta = 56.09 degrees for Fe3+ in GaF3:Fe3+ are determined, respectively, and the EPR spectra of the MF3:Fe3+ (M = Al, Ga) systems are satisfactorily explained. (C) 2009 Elsevier B.V. All rights reserved.
KeywordMF3:Fe3+ (M = Al, Ga) system Local lattice structure distortion EPR spectrum Ligand-fields theory
Funding OrganizationNational Natural Science Foundation ; Doctoral Education Fund of Education Ministry of China
DOI10.1016/j.jlumin.2009.10.011
Indexed BySCI
Language英语
Funding ProjectNational Natural Science Foundation[10374068] ; Doctoral Education Fund of Education Ministry of China[20050610011]
WOS Research AreaOptics
WOS SubjectOptics
WOS IDWOS:000273914900019
PublisherELSEVIER SCIENCE BV
Citation statistics
Cited Times:1[WOS]   [WOS Record]     [Related Records in WOS]
Document Type期刊论文
Identifierhttp://ir.imr.ac.cn/handle/321006/101197
Collection中国科学院金属研究所
Corresponding AuthorLi Ju-Fen
Affiliation1.SW Petr Univ, Sch Sci, Chengdu 610065, Peoples R China
2.Sichuan Univ, Inst Atom & Mol Phys, Chengdu 610065, Peoples R China
3.Chinese Acad Sci, Int Ctr Mat Phys, Shenyang 110016, Peoples R China
Recommended Citation
GB/T 7714
Li Ju-Fen,Kuang Xiao-Yu,Mao Ai-Jie. Theoretical studies of the optical and EPR spectra for Fe3+ ion in the MF3:Fe3+ (M = Al, Ga) systems[J]. JOURNAL OF LUMINESCENCE,2010,130(3):451-454.
APA Li Ju-Fen,Kuang Xiao-Yu,&Mao Ai-Jie.(2010).Theoretical studies of the optical and EPR spectra for Fe3+ ion in the MF3:Fe3+ (M = Al, Ga) systems.JOURNAL OF LUMINESCENCE,130(3),451-454.
MLA Li Ju-Fen,et al."Theoretical studies of the optical and EPR spectra for Fe3+ ion in the MF3:Fe3+ (M = Al, Ga) systems".JOURNAL OF LUMINESCENCE 130.3(2010):451-454.
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