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EN
An extension of the computer program superposition model-Monte Carlo (SPM-MC), designed for modelling of the spectroscopic and structural properties of transition ions at low symmetry sites in crystals, is presented. Special focus is put on two aspects. The first aspect concerns the effects of variation of the superposition model (SPM) parameters, i.e. the intrinsic parameters (b2, b4) and power low exponents (t2, t4), on the quality of fittings of experimental data and theoretical predictions. This enables to increase the reliability of the modelling results. The second aspect concerns the implications of low site symmetry on modelling of the pertinent properties. Applications of the program SPM-MC to Fe3+ ions at the triclinic (Ci) symmetry sites in YAlO3 (YAP) crystals are considered.
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Content available remote Molten salt synthesis of YAlO3 powders
EN
In this work, the molten salt synthesis technique was applied to the synthesis of YAlO3 powder using LiCl, NaCl or KClsalt as the flux. YAlO3 powder was synthesized by reacting equimolar amounts of Y2O3 and Al2O3 powders in LiCl salt. The synthesis temperature for YAlO3 using LiCl salt was 1300 which is by about 500 C lower than that in the conventional mixed-oxide method. The synthesized powders have been characterized using powder X-ray diffraction (XRD) analysis and field emission scanning electron microscopy (FE-SEM). The effect of the salt type on the formation of YAlO3 has also been investigated.
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