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Energy spectra, g factors and their pressure-induced and/or thermal shifts of SrTiO3 : Cr3+ and SrTiO3 : Mn4+I: Energy spectra and g factors at normal pressure
J. P. Zhang; D. P. Ma
2001
发表期刊Communications in Theoretical Physics
ISSN0253-6102
卷号35期号:4页码:491-496
摘要With the strong-field scheme and cubic bases, the complete d(3) energy matrix in a tetragonally distorted cubic-field has been constructed. By diagonalizing this matrix, the energy spectra of SrTiO3:Cr3+ and SrTiO3:Mn4+ at normal pressure and various temperatures have been calculated. Correspondingly, the FORTRAN program calculating the g factor of the ground state has been worked out. By using the program and the wave function obtained from diagonalizing the complete energy matrix, the g factors of the ground state of SrTiO3:Cr3+ and SrTiO3:Mn4+ at normal pressure and room temperature have been evaluated. The calculated results are in good agreement with the optical spectral and EPR experimental data. The comparison and analysis of the results of two crystals have been made. It is demonstrated that the covalency of the bonding between Mn4+ and ligands (O2-) in SrTiO3:Mn4+ is stronger than the one of the bonding between Cr3+ and ligands (O2-) in SrTiO3:Cr3+. It is shown that the obtained wavefunctions and values of parameters are reasonable.
部门归属sichuan univ, dept appl phys, chengdu 610065, peoples r china. chinese acad sci, int ctr mat phys, shenyang 110015, peoples r china.;zhang, jp (reprint author), sichuan univ, dept appl phys, chengdu 610065, peoples r china
关键词Crystal Fields Energy Spectrum Optical Properties g Factors Covalency Ruby
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WOS记录号WOS:000168939700022
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被引频次:5[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/321006/36898
专题中国科学院金属研究所
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J. P. Zhang,D. P. Ma. Energy spectra, g factors and their pressure-induced and/or thermal shifts of SrTiO3 : Cr3+ and SrTiO3 : Mn4+I: Energy spectra and g factors at normal pressure[J]. Communications in Theoretical Physics,2001,35(4):491-496.
APA J. P. Zhang,&D. P. Ma.(2001).Energy spectra, g factors and their pressure-induced and/or thermal shifts of SrTiO3 : Cr3+ and SrTiO3 : Mn4+I: Energy spectra and g factors at normal pressure.Communications in Theoretical Physics,35(4),491-496.
MLA J. P. Zhang,et al."Energy spectra, g factors and their pressure-induced and/or thermal shifts of SrTiO3 : Cr3+ and SrTiO3 : Mn4+I: Energy spectra and g factors at normal pressure".Communications in Theoretical Physics 35.4(2001):491-496.
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