Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
1626025 | Journal of Alloys and Compounds | 2007 | 6 Pages |
Abstract
The binary Ba–Ni and Ba–Ti systems are modeled by computational thermodynamics using the CALculation of PHAse Diagram (CALPHAD) method, wherein the thermodynamic parameters of disordered bcc, fcc and hcp phases are evaluated in terms of the first-principles calculations using the special quasirandom structures (SQSs). In combination with the Ni–Ti system modeling in the literature, the phase equilibria of the Ba–Ni–Ti system are predicted. Isothermal section of the ternary system is presented.
Keywords
Related Topics
Physical Sciences and Engineering
Materials Science
Metals and Alloys
Authors
Shunli Shang, Zhi-Jie Liu, Zi-Kui Liu,