Thermodynamic properties of Al, Ni, NiAl, and Ni3Al from first-principles calculations

Acta Materialia

Volumn 52, Issue 9, 2004, Pages 2665-2671

  Wang, Y ^a   Liu, Z K ^a   Chen, L Q ^a  

^a PENNSYLVANIA STATE UNIVERSITY   (United States)

Author keywords

Ab initio electron theory; Aluminium alloys; Nickel alloys; Thermodynamics

Indexed keywords

ALUMINUM ALLOYS; APPROXIMATION THEORY; CARRIER CONCENTRATION; ENTHALPY; FERMI LEVEL; FREE ENERGY; GRADIENT METHODS; LATTICE VIBRATIONS; PHASE DIAGRAMS; THERMAL EXPANSION; THERMODYNAMICS;

AB INITIO ELECTRON THEORY; ELECTRONIC EXCITATION; LINEAR-RESPONSE THEORY;

NICKEL ALLOYS;

EID: 2342515450     PISSN: 13596454     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.actamat.2004.02.014     Document Type: Article

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