2006Crystallography ReportsRequires access

Crystal structure of the new barium borate Ba5(BO3)2(B2O5)

N. G. Furmanova, B. A. Maksimov, V. N. Molchanov, А. Е. Кох, Н. Г. Кононова, П. П. Федоров

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Abstract

The crystal structure of the new barium borate Ba 5 (BO 3 ) 2 (B 2 O 5 ) is established ( R = 0.0436). Single crystals were grown by spontaneous crystallization in the BaO-B 2 O 3 -Na 2 O system using the flux method. This compound crystallizes in the orthorhombic system, sp. gr. P 2 1 2 1 2 1 ; the unit-cell parameters are a = 9.590(2) Å, b = 16.659(3) Å, c = 22.919(6) Å, and Z = 12. The structure consists of coordination polyhedra of barium cations and the anionic groups [BO 3 ] (planar triangles) and [B 2 O 5 ] (vertex-sharing double [BO 3 ] triangles), which form a pseudohexagonal framework. Melting of barium borate occurs by a peritectic reaction at 1170 ± 10°C.

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The crystal structure of the new barium borate Ba 5 (BO 3 ) 2 (B 2 O 5 ) is established ( R = 0.0436). Single crystals were grown by spontaneous crystallization in the BaO-B 2 O 3 -Na 2 O system using the flux method. This compound crystallizes in the orthorhombic system, sp. gr. P 2 1 2 1 2 1 ; the unit-cell parameters are a = 9.590(2) Å, b = 16.659(3) Å, c = 22.919(6) Å, and Z = 12. The structure consists of coordination polyhedra of barium cations and the anionic groups [BO 3 ] (planar triangles) and [B 2 O 5 ] (vertex-sharing double [BO 3 ] triangles), which form a pseudohexagonal framework. Melting of barium borate occurs by a peritectic reaction at 1170 ± 10°C.

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Available abstract

The crystal structure of the new barium borate Ba 5 (BO 3 ) 2 (B 2 O 5 ) is established ( R = 0.0436). Single crystals were grown by spontaneous crystallization in the BaO-B 2 O 3 -Na 2 O system using the flux method. This compound crystallizes in the orthorhombic system, sp. gr. P 2 1 2 1 2 1 ; the unit-cell parameters are a = 9.590(2) Å, b = 16.659(3) Å, c = 22.919(6) Å, and Z = 12. The structure consists of coordination polyhedra of barium cations and the anionic groups [BO 3 ] (planar triangles) and [B 2 O 5 ] (vertex-sharing double [BO 3 ] triangles), which form a pseudohexagonal framework. Melting of barium borate occurs by a peritectic reaction at 1170 ± 10°C.

Key concepts: Orthorhombic crystal system, Barium, Boron, Crystallography, Crystal structure, Chemistry, Barium borate, Crystallization

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