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Träfflista för sökning "(WFRF:(Simak V.)) srt2:(2001-2004) srt2:(2003)"

Search: (WFRF:(Simak V.)) srt2:(2001-2004) > (2003)

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1.
  • Ruban, Andrei V., et al. (author)
  • Local lattice relaxations in random metallic alloys : Effective tetrahedron model and supercell approach
  • 2003
  • In: Physical Review B. Condensed Matter and Materials Physics. - 1098-0121 .- 1550-235X. ; 67:21
  • Journal article (peer-reviewed)abstract
    • We present a simple effective tetrahedron model for local lattice relaxation effects in random metallic alloys on simple primitive lattices. A comparison with direct ab initio calculations for supercells representing random Ni0.50Pt0.50 and Cu0.25Au0.75 alloys as well as the dilute limit of Au-rich CuAu alloys shows that the model yields a quantitatively accurate description of the relaxtion energies in these systems. Finally, we discuss the bond length distribution in random alloys.
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  • Result 1-2 of 2
Type of publication
journal article (2)
Type of content
peer-reviewed (2)
Author/Editor
Simak, S. I. (2)
Ruban, Andrei V. (1)
Skorodumova, Natalia ... (1)
Skriver, H. L. (1)
Shallcross, S. (1)
University
Royal Institute of Technology (1)
Uppsala University (1)
Language
English (2)
Research subject (UKÄ/SCB)
Natural sciences (1)
Year
2003 (2)Undo refine

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