Dipraseodymium molybdenum scandium hepta-oxide, Pr2Mo1.73Sc0.27O7, crystallizes in the cubic pyrochlore-type structure. In the crystal, (Mo,Sc)O6 octa-hedra are linked together by common corners, forming a three-dimensional [(Mo,Sc)2O6] framework. The Pr atom and another O atom atom are located in the voids of this framework. The Mo and the Sc atom are distributed statistically over the same 16d crystallographic position, with site-occupancy factors of 0.867 (3) and 0.133 (3), respectively. The Pr(3+) ions are surrounded by six O atoms from the MoO6 octa-hedra and by two other O atoms, forming a ditrigonal scalenohedron. All atoms lie on special positions. The Pr and the statistically distributed (Mo,Sc) sites are in the 16c and 16d positions with .-3m symmetry, and two O atoms are in 48f and 8a positions with 2.mm and -43m site symmetry, respectively.
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http://dx.doi.org/10.1107/S1600536812045138 | DOI Listing |
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Key Laboratory of Chemical Additives for China National Light Industry, College of Chemistry and Chemical Engineering, Shaanxi University of Science and Technology, Xi'an 710021, China.
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Key Laboratory of Synthetic and Biological Colloids, Ministry of Education, School of Chemical and Material Engineering, Jiangnan University, Wuxi, 214122, China.
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View Article and Find Full Text PDFSci Rep
December 2024
Department of Mathematics, Payame Noor University, Tehran, Iran.
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View Article and Find Full Text PDFJ Chem Theory Comput
December 2024
Max Planck Institute for the Structure and Dynamics of Matter, Luruper Ch 149, Hamburg 22761, Germany.
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