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First Principles Calculation of the Interdiffusion Coefficient in Binary Alloys

โœ Scribed by Van der Ven, A.; Ceder, G.


Book ID
118262444
Publisher
The American Physical Society
Year
2005
Tongue
English
Weight
126 KB
Volume
94
Category
Article
ISSN
0031-9007

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We present an approach to calculate the atomic bulk solubility in binary alloys based on the statistical-thermodynamic theory of dilute lattice gas. The model considers all the appropriate ground states of the alloy and results in a simple Arrhenius-type temperature dependence determined by a ''low-