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Electronic structure and stability of Mg–Ce intermetallic compounds from first-principles calculations

✍ Scribed by D.W. Zhou; P. Peng; J.S. Liu


Book ID
116600525
Publisher
Elsevier Science
Year
2007
Tongue
English
Weight
502 KB
Volume
428
Category
Article
ISSN
0925-8388

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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