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First-Principles Study of Structural and Defect Properties in FeCo Intermetallics

✍ Scribed by Krcmar, M.; Fu, C. L.; Morris, J. R.

Book ID
120837766
Publisher
Cambridge University Press
Year
2004
Weight
83 KB
Volume
842
Category
Article
ISSN
0272-9172

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In this work, the structural stabilities and electronic properties of Mg-Nd intermetallic compounds were investigated using firstprinciples calculations based on density functional theory. The present results showed that lattice constants for all intermetallics considered are very close to the corre