Article ID Journal Published Year Pages File Type
1613772 Journal of Alloys and Compounds 2013 4 Pages PDF
Abstract
► Cluster variation method is extended to study displacive transition. ► Electronic structure total energy calculations are performed on ZrO2. ► Tetragonal-cubic transition is studied within the framework of order -disorder transition.
Keywords
Related Topics
Physical Sciences and Engineering Materials Science Metals and Alloys
Preview
First-principles cluster variation calculations of tetragonal-cubic transition in ZrO2
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