Energetics of homogeneously-random fcc Al-Ag alloys: A detailed comparison of computational methods

Computational Materials Science

Volumn 8, Issue 1-2, 1997, Pages 54-63

  Johnson, D D ^a   Asta, Mark ^a  

^a SANDIA NATIONAL LABORATORIES   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; BINARY ALLOYS; COMPUTATIONAL METHODS; CRYSTAL STRUCTURE; ELECTRONIC STRUCTURE; ENTHALPY; THERMODYNAMICS;

KORRINGA-KOHN-ROSTOKER COHERENT POTENTIAL APPROXIMATION (KKR-CPA); LINEAR MUFFIN TIN ORBITAL (LMTO) METHOD; SPECIAL QUASI-RANDOM STRUCTURE (SQS) METHOD; STRUCTURAL INVERSION METHOD (SIM);

ALUMINUM ALLOYS;

EID: 0031143922     PISSN: 09270256     EISSN: None     Source Type: Journal    
DOI: 10.1016/s0927-0256(97)00016-5     Document Type: Review

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