Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
1625343 | Journal of Alloys and Compounds | 2008 | 5 Pages |
Abstract
For a d3 configuration ion, the 120Â ÃÂ 120 complete energy matrix which contains the electron-electron repulsion interaction, the ligand field interaction, the spin-orbit coupling interaction as well as the Zeeman interaction, has been established. By diagonalizing the complete energy matrix, local structure and EPR g factors for Cr3+ ions doped in KAl(MoO4)2 and RbIn(MoO4)2 have been investigated, respectively. It is found that the orbit reduction effect is very important to understand the EPR g factors for Cr3+ ions doped in KAl(MoO4)2 and RbIn(MoO4)2, and some characteristics of orbit reduction on the EPR g factors are discussed firstly. Simultaneously, by simulating the calculated optical spectra and the EPR spectra data to the experimental results, we obtain the local structure parameters RÂ =Â 2.043Â Ã
, θ = 53.5940° and R = 2.065 Ã
, θ = 56.0434° for Cr3+ ions doped in KAl(MoO4)2 and RbIn(MoO4)2, respectively. The calculated results show the local lattice structure of the octahedral Cr3+ centers in KAl(MoO4)2 and RbIn(MoO4)2 exhibit an elongation and a compression distortions, respectively.
Keywords
Related Topics
Physical Sciences and Engineering
Materials Science
Metals and Alloys
Authors
Ai-Jie Mao, Xiao-Yu Kuang, Hui Wang, Xiao-Fen Huang,