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Determination of the structure of y-alumina from interatomic potential and first principles calculations: The requirement of significant numbers of nonspinel positions to achieve an accurate structural model

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Authors
Paglia, Gianluca
Rohl, Andrew
Buckley, Craig
Gale, Julian
Date
2005
Type
Journal Article

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Paglia, Gianluca and Rohl, Andrew and Buckley, Craig and Gale, Julian. 2005. Determination of the structure of y-alumina from interatomic potential and first principles calculations: The requirement of significant numbers of nonspinel positions to achieve an accurate structural model. Physical Review B. 71: 224115-1.
Source Title
Physical Review B
DOI
Faculty
Department of Applied Physics
Division of Engineering, Science and Computing
Faculty of Science
School
Department of Imaging and Applied Physics
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Copyright 2005 The American Physical Society

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