Thermodynamic modeling of Laves phases in the Cr-Hf and Cr-Ti systems: Reassessment using first-principles results

Calphad: Computer Coupling of Phase Diagrams and Thermochemistry

Volumn 34, Issue 2, 2010, Pages 215-221

  Pavlu J ^a,b   Vrest'Al J ^a,b   Sob M ^a,b  

^a MASARYK UNIVERSITY   (Czech Republic)

^b INSTITUTE OF PHYSICS OF MATERIALS   (Czech Republic)

Author keywords

Ab initio calculations; Chromiumhafnium system; Chromiumtitanium system; Laves phases; Phase diagrams

Indexed keywords

AB INITIO CALCULATIONS; BELONG TO; CHROMIUMHAFNIUM SYSTEM; CHROMIUMTITANIUM SYSTEM; FIRST-PRINCIPLES; FITTING PARAMETERS; GIBBS ENERGY; HEAT CAPACITIES; IN-PHASE; LAVES PHASIS; MAGNETIC ORDERS; PHASE DATA; POLYTYPES; RELATIVE STABILITIES; SUB-LATTICE MODEL; THERMODYNAMIC DESCRIPTION; THERMODYNAMIC MODELING; TOTAL ENERGY;

BINARY MIXTURES; CALCULATIONS; HAFNIUM; PHASE DIAGRAMS; THERMODYNAMICS;

CHROMIUM;

EID: 77955660667     PISSN: 03645916     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.calphad.2010.03.003     Document Type: Article

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