Theoretical investigation of Fe-based phase equilibria from the first-principles

Materials Science Forum

Volumn 475-479, Issue IV, 2005, Pages 3127-3130

  Chen, Ying ^a   Iwata, Shuichi ^a   Mohri, Tetsuo ^b  

^a UNIVERSITY OF TOKYO   (Japan)

^b HOKKAIDO UNIVERSITY   (Japan)

Author keywords

Cluster expansion method; Cluster variation method; Debye Gruneisen model; Fe Pt, Pd, Ni alloy system; First principles calculations; Magnetism; Order disorder

Indexed keywords

APPROXIMATION THEORY; GRADIENT METHODS; MAGNETISM; MATHEMATICAL MODELS; ORDER DISORDER TRANSITIONS; PHASE EQUILIBRIA; STOICHIOMETRY; THERMAL EFFECTS;

CLUSTER EXPANSION METHOD; CLUSTER VARIATION METHOD; DEBYE-GRUNEISEN MODEL; FE-NI ALLOYS; FE-PD ALLOYS; FE-PT ALLOYS; FIRST PRINCIPLE CALCULATIONS;

IRON ALLOYS;

EID: 17044422109     PISSN: 02555476     EISSN: 16629752     Source Type: Book Series    
DOI: 10.4028/0-87849-960-1.3127     Document Type: Conference Paper

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