Title of article :
Thermodynamic assessments of the Ni–Pt and Al–Ni–Pt systems
Author/Authors :
Lu، نويسنده , , Xiao-Gang and Sundman، نويسنده , , Bo and A?gren، نويسنده , , John، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2009
Abstract :
The Ni–Pt system is assessed using the CALPHAD method. The four fcc-based phases, i.e. disordered solid solution phase, Ni3Pt–L12, NiPt–L10 and NiPt3–L12, are described by a four-sublattice model. The calculated thermodynamic properties and order/disorder phase transformations are in good agreement with the experimental data. In order to facilitate the assessment, first-principles pseudopotential calculations are also performed to calculate the enthalpy of formation at 0 K, and comparison with the assessed values is discussed. By combining the assessments of Al–Ni and Al–Pt, the Al–Ni–Pt ternary system is assessed within a narrow temperature range, focusing on the fcc-based phases and their phase equilibria with B2 phase.
Keywords :
Thermodynamics , CALPHAD , first-principles , Ni–Pt , Al–Ni–Pt