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LiBaAlF6 and the crystal chemistry of LiAIIBIIIF6 phases
Lithium barium hexafluoroaluminate (LBAF), LiBaAlF6, is a new member of the large family of compounds of formula LiAIIBIIIF6. These materials display a variety of structures depending on the sizes of the A and B cations. LiBaAlF6, which is isomorphous with LiBaCoF6, belongs to the monoclinic P21/c s...
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Published in: | Acta crystallographica. Section C, Crystal structure communications Crystal structure communications, 2008-07, Vol.64 (7), p.i66-i68 |
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container_title | Acta crystallographica. Section C, Crystal structure communications |
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creator | Merkulov, Alexander A. Isaenko, Ludmila I. Lobanov, Sergey I. Naumov, Dmitry Yu Kuratieva, Natalia V. |
description | Lithium barium hexafluoroaluminate (LBAF), LiBaAlF6, is a new member of the large family of compounds of formula LiAIIBIIIF6. These materials display a variety of structures depending on the sizes of the A and B cations. LiBaAlF6, which is isomorphous with LiBaCoF6, belongs to the monoclinic P21/c subset and has a three‐dimensional network structure consisting of distorted LiF43− tetrahedra corner‐sharing with AlF63− octahedra and BaF12 polyhedra. All of the atoms reside on general positions. An analysis of the ionic radii of the A cations versus formula volumes for the known members of the family yields a structure map that reasonably segregates the compounds by space group. The data obtained are thus suitable for predicting new isomorphic crystal structures. |
doi_str_mv | 10.1107/S0108270108017538 |
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title | LiBaAlF6 and the crystal chemistry of LiAIIBIIIF6 phases |
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