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Despite numerous investigations, all previous efforts on thermodynamic modeling of Al–Mg have suffered from inaccurate energetics of solid phases. In the present work, the first-principles calculations were performed using VASP based on the pseudo-potentials and a plane wave basis set. The enthalpies of formation of the ε-Al30Mg23 phase, end-members of the γ-Al12Mg17 phase, and three laves phases...
It has been recently discovered that the compound MgB 2 possesses superconductivity at 39K. To better design and control the fabrication of the MgB 2 compound, a complete thermodynamic description of the system is desirable. In the present work, the phase equilibria and thermodynamic properties of the binary Mg-B system were analyzed and a complete thermodynamic description of the...
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