Structure cristalline de K3NbAs2O9
Identifieur interne : 001517 ( Main/Exploration ); précédent : 001516; suivant : 001518Structure cristalline de K3NbAs2O9
Auteurs : Mohamed Faouzi Zid [Tunisie] ; Tahar Jouini [Tunisie] ; Noureddine Jouini [Tunisie] ; Mohamed Omezzine [Tunisie]Source :
- Journal of Solid State Chemistry [ 0022-4596 ] ; 1989.
Abstract
Abstract: K3NbAs2O9 is a new compound of Mr = 503.4: orthorhombic, Pnma, a = 22.389(6), b = 5.436(1), c = 7.870(2) Å, V = 957.8 Å3, Z = 4, ρ = 3.495 g/cm3, AgKα, λ = 0.5608 Å, μ = 97.6 cm−1, F(000) = 1287, R = 0.050, wR = 0.046 for 661 independent reflections. The structure contains chains of AsO4 tetrahedra and NbO6 octahedra sharing corners. They are staggered and connected by NbO(5)As bridges to form «puckeredå layers parallel to the bc plane. The K+ ions, located in channels communicating by the interlayer spaces, contribute mainly by holding together chains belonging to the same layer. Although the niobium atom is off-center in an “O6” octahedron and forms a short NbOaxial(1) distance and a long NbOaxial(5) distance, the hypothesis of square pyramidal coordination is rejected by showing indirectly the influence of the Nb atom on O(5) from a comparison between the AsOequatorial and the AsO(5) distances in the NbOAs bridges. The structure of β-TaH(PO4)2 (three-dimensional anion) derives from that of K3NbAs2O9 (two-dimensional) through the sharing of the homolog of O(1) between successive layers, thus locking the communication between the channels containing the H+ ions.
Url:
DOI: 10.1016/0022-4596(89)90216-8
Affiliations:
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Le document en format XML
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<front><div type="abstract" xml:lang="en">Abstract: K3NbAs2O9 is a new compound of Mr = 503.4: orthorhombic, Pnma, a = 22.389(6), b = 5.436(1), c = 7.870(2) Å, V = 957.8 Å3, Z = 4, ρ = 3.495 g/cm3, AgKα, λ = 0.5608 Å, μ = 97.6 cm−1, F(000) = 1287, R = 0.050, wR = 0.046 for 661 independent reflections. The structure contains chains of AsO4 tetrahedra and NbO6 octahedra sharing corners. They are staggered and connected by NbO(5)As bridges to form «puckeredå layers parallel to the bc plane. The K+ ions, located in channels communicating by the interlayer spaces, contribute mainly by holding together chains belonging to the same layer. Although the niobium atom is off-center in an “O6” octahedron and forms a short NbOaxial(1) distance and a long NbOaxial(5) distance, the hypothesis of square pyramidal coordination is rejected by showing indirectly the influence of the Nb atom on O(5) from a comparison between the AsOequatorial and the AsO(5) distances in the NbOAs bridges. The structure of β-TaH(PO4)2 (three-dimensional anion) derives from that of K3NbAs2O9 (two-dimensional) through the sharing of the homolog of O(1) between successive layers, thus locking the communication between the channels containing the H+ ions.</div>
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