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• W2088592014 abstract "The electron paramagnetic resonance spectra of layered perovskite Rb2ZnF4 and Rb2CdF4 doped with Fe3+ are studied by means of a 252 x 252 complete energy matrix for a 3d(5) configuration ion in a tetragonal ligand-field. The local structure parameters R-perpendicular to and R-parallel to for Rb2ZnF4:Fe3+ and Rb2CdF4:Fe3+ systems are determined. The calculations show that the local lattice of the Rb2ZnF4:Fe3+ and Rb2CdF4:Fe3+ systems display a compression distortion relative to the regular octahedron. Besides, the value of R-perpendicular to in Rb2ZnF4 and Rb2CdF4 crystals is, respectively, larger than that in Rb2ZnF4:Fe3+ and Rb2CdF4:Fe3+ systems. This may be ascribed to the fact that Fe3+ ions have the smaller ionic radius and larger charge in comparison to Zn2+ and Cd2+ ions. In the end, the relative curves of 10(4)b(2)(0), vs. Delta R (Delta R = R-perpendicular to - R-parallel to) for these two systems are plotted which satisfy an approximately linear relation. (c) 2007 Elsevier B.V. All rights reserved." @default.
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• W2088592014 date "2007-04-01" @default.
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• W2088592014 title "Theoretical study of local structure of tetragonal Fe3+ center in layered perovskite Rb2ZnF4 and Rb2CdF4" @default.
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• W2088592014 doi "https://doi.org/10.1016/j.chemphys.2007.02.022" @default.
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