Thermodynamic assessments of the Ni-Pt and Al-Ni-Pt systems

被引:75
|
作者
Lu, Xiao-Gang [1 ]
Sundman, Bo [1 ]
Agren, John [1 ]
机构
[1] Royal Inst Technol, Dept Mat Sci & Engn, SE-10044 Stockholm, Sweden
基金
美国国家科学基金会;
关键词
Thermodynamics; CALPHAD; First-principles; Ni-Pt; Al-Ni-Pt; NICKEL-PLATINUM ALLOYS; AUGMENTED-WAVE METHOD; PHASE-DIAGRAM; BEHAVIOR; AU;
D O I
10.1016/j.calphad.2009.06.002
中图分类号
O414.1 [热力学];
学科分类号
摘要
The Ni-Pt system is assessed using the CALPHAD method. The four fcc-based phases, i.e. disordered solid solution phase, Ni(3)Pt-L1(2), NiPt-L1(0) and NiPt(3)-L1(2), 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. (C) 2009 Elsevier Ltd. All rights reserved.
引用
收藏
页码:450 / 456
页数:7
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