Guangcheng Xiao, Yuduo Wei, Yueyan Tian, Lideng Ye, Jifeng Yang, Kaige Wang, Zixuan Deng, Ligang Zhang, Libin Liu
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引用次数: 0
Abstract
Based on experimental data measured by scanning electron microscope (SEM), X-ray diffraction (XRD) and electron probe microanalysis (EPMA), isothermal sections of Ti–Mo-Hf system at 800 °C and 1000 °C were constructed. Four and three three-phase regions were derived in the isothermal sections at 800 and 1000 °C, respectively. In addition, a new ternary compound named τ was discovered. The maximum solubilities of the three elements, Ti, Mo and Hf in τ were measured at 800 °C and 1000 °C. At the same time, the solid solubilities of Ti in HfMo2_C15 and Mo in Hcp were also obtained. According to the measured experimental data, the Ti–Mo-Hf system was optimized using the CALPHAD (CALculation of PHAse Diagrams) method. The solution phases, liquid, Bcc and Hcp, were treated as substitutional solution, while the intermetallic compounds were modeled using sublattice models. HfMo2_C15 was treated as (Hf, Mo, Ti)1(Hf, Mo, Ti)2. The ternary phase τ was considered as a stoichiometric compound and its thermodynamic modeling was defined as (Ti)3(Mo)3(Hf)14. The calculated results showed good agreement with the experimental phase equilibrium data, leading to the derivation of a set of self-consistent thermodynamic parameters for the Ti–Mo-Hf system.
期刊介绍:
The design of industrial processes requires reliable thermodynamic data. CALPHAD (Computer Coupling of Phase Diagrams and Thermochemistry) aims to promote computational thermodynamics through development of models to represent thermodynamic properties for various phases which permit prediction of properties of multicomponent systems from those of binary and ternary subsystems, critical assessment of data and their incorporation into self-consistent databases, development of software to optimize and derive thermodynamic parameters and the development and use of databanks for calculations to improve understanding of various industrial and technological processes. This work is disseminated through the CALPHAD journal and its annual conference.