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Electronic Structure and Phase Stability Properties of Ai-Li Alloys

  • Antonios Gonis (a1), Patrice E.A. Turchi (a1), Marcel Sluiter (a1), Frank J. Pinski (a2) and Duane D. Johnson (a3)...

Abstract

Recently, the phase diagram of AI-Li alloys was calculated with the use of the Connolly-Williams method. In an effort to test the validity and to supplement the results of that study, equilibrium lattice constants and effective cluster interactions have been obtained using the generalized perturbation method within the first-principles multiple-scattering formalism of the Korringa-Kohn-Rostoker coherent-potential approximation. The implication of these effective interactions to the phase stability of these alloys is discussed.

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Electronic Structure and Phase Stability Properties of Ai-Li Alloys

  • Antonios Gonis (a1), Patrice E.A. Turchi (a1), Marcel Sluiter (a1), Frank J. Pinski (a2) and Duane D. Johnson (a3)...

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