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Electronic Structure and Phase Stability Properties of Al-Li Alloy

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Abstract

Recently, the phase diagram of Al-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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Authors and Affiliations

  1. Chemistry and Materials Science, Lawrence Livermore National Laboratory, L-268, Livermore, CA, 94550, USA

    Antonio Gonis, Patrice E. A. Turchi & Marcel Sluiter

  2. Physics Department, University of Cincinnati, Cincinnati, OH, 45221, USA

    Frank J. Pinski

  3. Sandia National Laboratories, 8341 East Ave., Livermore, CA, 94450, USA

    Duane D. Johnson

Authors
  1. Antonio Gonis
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  2. Patrice E. A. Turchi
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  3. Marcel Sluiter
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  4. Frank J. Pinski
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  5. Duane D. Johnson
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Gonis, A., Turchi, P.E.A., Sluiter, M. et al. Electronic Structure and Phase Stability Properties of Al-Li Alloy. MRS Online Proceedings Library 186, 89–93 (1990). https://doi.org/10.1557/PROC-186-89

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  • DOI: https://doi.org/10.1557/PROC-186-89

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