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Synthesis and crystal structure of LiBa2N and identification of LiBa3N

MPS-Authors
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Smetana,  V.
Former Departments, Max Planck Institute for Solid State Research, Max Planck Society;
Department Nanochemistry (Bettina V. Lotsch), Max Planck Institute for Solid State Research, Max Planck Society;

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Babizhetskyy,  V.
Department Quantum Materials (Hidenori Takagi), Max Planck Institute for Solid State Research, Max Planck Society;
Former Departments, Max Planck Institute for Solid State Research, Max Planck Society;
Department Nanochemistry (Bettina V. Lotsch), Max Planck Institute for Solid State Research, Max Planck Society;

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Vajenine,  G. V.
Former Departments, Max Planck Institute for Solid State Research, Max Planck Society;

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Simon,  A.
Former Departments, Max Planck Institute for Solid State Research, Max Planck Society;

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Citation

Smetana, V., Babizhetskyy, V., Vajenine, G. V., & Simon, A. (2007). Synthesis and crystal structure of LiBa2N and identification of LiBa3N. Journal of Solid State Chemistry, 180(6), 1889-1893.


Cite as: https://hdl.handle.net/21.11116/0000-000E-B4D1-A
Abstract
The metal-rich part of the Li-Ba-N system was investigated using powder and single-crystal X-ray diffraction analysis. The crystal structures of two new ternary subnitrides, LiBa2N and of LiBa3N, were determined from single-crystal and powder X-ray diffraction data, respectively, LiBa2N has a tetragonal structure (space group, P4(2)/nMC, Z = 8, a = 7.980(1), c = 14.263(2) angstrom). The structure contains infinite mutually perpendicular rows of edge-sharing LiBa5N octahedra. LiBa3N is isostructural with NaBa3N (P6(3)/mmc, Z = 2, a = 8.182(1), c = 6.922(4)angstrom). (c) 2007 Elsevier Inc. All rights reserved.