Browsing Computational File Repository by Author "Xuan L. Liu"
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First-Principles Calculations, Experimental Study, and Thermodynamic Modeling of the Al-Co-Cr System
Xuan L. Liu; Thomas Gheno; Bonnie B. Lindahl; Greta Lindwall; Brian Gleeson; Zi-Kui LiuThe phase relations and thermodynamic properties of the condensed Al-Co-Cr ternary alloy system are investigated using first-principles calculations based on density functional theory (DFT) and phase-equilibria experiments ... -
Thermodynamic modeling of Al–Co–Cr, Al–Co–Ni, Co–Cr–Ni ternary systems towards a description for Al–Co–Cr–Ni
Xuan L. Liu; Greta Lindwall; Thomas Gheno; Zi-Kui LiuThe phase relations and thermodynamic properties of the Al–Co–Cr, Al–Co–Ni, Co–Cr–Ni ternary alloys are investigated using first principles calculations based on DFT (density functional theory). Their thermodynamic ...