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|Title: ||Geometric parameterization of the YBaCo4O7 structure type: implications for stability of the hexagonal form and oxygen uptake.|
|Authors: ||Avdeev, M|
|Issue Date: ||Oct-2010|
|Citation: ||Avdeev, M., Kharton, V. V., & Tsipis, E. V. (2010). Geometric parameterization of the YBaCo4O7 structure type: implications for stability of the hexagonal form and oxygen uptake. Journal of Solid State Chemistry, 183(10), 2506-2509.|
|Abstract: ||We explore the stability of the hexagonal form of MBaCo4O7 cobaltites in terms of geometric characteristics of the crystal structure and Global Instability Index (GII) based on the bond-valence considerations. Mismatch between an M3+/2+ and the three-dimensional network of CoO4 tetrahedra, whether expressed using an M ionic radii or GII, is shown to essentially determine both the temperature of structural transition to an orthorhombic modification and oxygen storage properties. A number of M cations not reported in the literature are identified to be suitable for the octahedral sites in an MBaCo4O7 structure. © 2010, Elsevier Ltd.|
|Appears in Collections:||Journal Articles|
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