First-principles calculations of the Zn-Zr system

Acta Materialia

Volumn 54, Issue 2, 2006, Pages 473-482

  Arroyave, R ^a   Van De Walle, A ^b   Liu, Z K ^a  

^a PENNSYLVANIA STATE UNIVERSITY   (United States)

^b Northwestern University   (United States)

Author keywords

First principles electron theory; Intermetallic phases; Thermodynamics; Zn Zr

Indexed keywords

APPROXIMATION THEORY; FREE ENERGY; HARMONIC ANALYSIS; INTERMETALLICS; MATHEMATICAL MODELS; PHASE DIAGRAMS; THERMODYNAMICS;

FIRST-PRINCIPLES ELECTRON THEORY; HULL CONSTRUCTION; INTERMETALLIC PHASES; ZN-ZR;

ZINC COMPOUNDS;

EID: 28944448864     PISSN: 13596454     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.actamat.2005.09.018     Document Type: Article

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