Temperature dependent electronic transport in concentrated solid solutions of the 3d-transition metals Ni, Fe, Co and Cr from first principles.

ORAL

Abstract

An approach to the calculation of transport coefficients is applied to the calculation of transport properties of fcc alloys of Ni, Fe, Co, Cr. The coherent potential approximation used to treat chemical disorder, temperature induced magnetic moment fluctuations and lattice vibrations via the alloy analogy. For the nonmagnetic alloys, Ni20Cr, and NiCoCr the combined effects of chemical disorder and lattice vibrations result in a monotonic increase in the resistivity as a function of temperature from an already large residual resistivity. For magnetic NiCo, NiFe, NiFeCo, additional electron scattering from magnetic fluctuations results in a rapid increase of the resistivity with temperature.The electronic part of the thermal conductivity in Ni20Cr, and NiCoCr, monotonically increases with temperature. In the magnetic alloys, electron scattering from magnetic fluctuations leads to an initial rapid decrease in thermal conductivity until this is overcome by an increasing number of carriers.

*This work was supported as part of the Energy Dissipation to Defect Evolution, an EFRC funded by the US DOE, Office of Science, BES under Contract DE-AC05-00OR22725; Office of Science, BES, Materials Sciences and Engineering Division; Deutsche Forschungsgemeinschaft Priority Program SPP 1538.

Presenters

  • German Samolyuk

    • Oak Ridge National Laboratory
    • Materials Science and Technology Division, Oak Ridge National Laboratory

Authors

  • German Samolyuk

    • Oak Ridge National Laboratory
    • Materials Science and Technology Division, Oak Ridge National Laboratory
  • Sai Mu

    • Oak Ridge National Laboratory
    • Materials Science and Technology Division, Oak Ridge National Laboratory
    • Department of Condensed Matter Physics and Materials Science, Oak Ridge National Laboratory
  • Andrew May

    • Materials Science & Technology Division, Oak Ridge National Laboratory, Oak Ridge, TN 37831, USA
    • Oak Ridge National Laboratory
    • Materials Science and Technology Division, Oak-Ridge National Laboratory
    • Materials Science and Technology Division, Oak Ridge National Lab
    • Materials Science and Technology Division, Oak Ridge National Laboratory
  • Sebastian Wimmer

    • Department Chemie/Physikalische Chemie, Ludwig-Maximilians-Universitat Munchen
  • Sergiy Mankovsky

    • Department Chemie/Physikalische Chemie, Ludwig-Maximilians-Universitat Munchen
  • Hubert Ebert

    • Department Chemie/Physikalische Chemie, Ludwig-Maximilians-Universitat Munchen
    • Ludwig-Maximilians-Universitat Munchen
  • Brian Craig Sales

    • Oak Ridge National Laboratory
  • George Malcolm Stocks

    • Oak Ridge National Laboratory