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Classical interatomic potential for Nb-alumina interfaces
K. Albe
, R. Benedek
, D. N. Seidman
,
R. S. Averback
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peer-review
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Keyphrases
Aluminides
25%
Aluminum Oxide
100%
Classical Interatomic Potential
100%
Density Functional Calculations
50%
Embedded Atom Method
50%
Interface Properties
25%
Local Density Functional
50%
Metal-oxide Interface
50%
Method Parameters
25%
Modified Embedded-atom Method
100%
Nb Oxide
25%
Niobium
25%
Niobium Aluminides
25%
Niobium Oxide
25%
Sapphire
25%
Ternary System
25%
Work of Separation
25%
Material Science
Aluminide
100%
Aluminum Oxide
100%
Density
100%
Interface Property
50%
Metal Oxide
50%
Metal-Oxide Interface
50%
Niobium
50%
Niobium Oxide
50%
Oxide Compound
50%
Sapphire
50%