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Pseudopotentials and Alloying Behaviour

  • A. de Rooy
  • E. W. van Royen
  • J. T. W. de Hosson

Abstract

The effective interatomic potentials of the transition metals are reported which are calculated within the framework of the pseudopotential approximation based on a model potential of the Heine Abarenkov type. The results obtained are combined with the cluster variation method in order to make predictions on the phase diagram of the ternary system CuNiZn. The predictions on the phase diagram are in reasonable agreement with experiments taking into account more-body forces and are topologically correct.

Keywords

Phase Diagram Schrodinger Equation Calculated Phase Diagram Cluster Variation Method Experimental Phase Diagram 
These keywords were added by machine and not by the authors. This process is experimental and the keywords may be updated as the learning algorithm improves.

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Copyright information

© Plenum Press, New York 1981

Authors and Affiliations

  • A. de Rooy
    • 1
  • E. W. van Royen
    • 1
  • J. T. W. de Hosson
    • 1
  1. 1.Department of Applied Physics, Materials Science CentreRijksuniversiteit GroningenGroningenThe Netherlands

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