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  • The phase boundaries between ferromagnetic and non-magnetic states were determined along the tetragonal deformation path of Ni3Al in L12 structure by means of ab initio electronic structure calculations. The origin of the magnetic behavior was analyzed by Stoner criterion and local environmental analysis. The ferromagnetic ordering occurs if at least 8 atoms of nickel are present in first two coordination spheres and their mutual distance does not exceed 0.054a, where a is the lattice constant of the L12 structure
  • The phase boundaries between ferromagnetic and non-magnetic states were determined along the tetragonal deformation path of Ni3Al in L12 structure by means of ab initio electronic structure calculations. The origin of the magnetic behavior was analyzed by Stoner criterion and local environmental analysis. The ferromagnetic ordering occurs if at least 8 atoms of nickel are present in first two coordination spheres and their mutual distance does not exceed 0.054a, where a is the lattice constant of the L12 structure (en)
Title
  • THE LOSS OF MAGNETISM OF Ni3Al ALONG TETRAGONAL DEFORMATION PATH
  • THE LOSS OF MAGNETISM OF Ni3Al ALONG TETRAGONAL DEFORMATION PATH (en)
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  • THE LOSS OF MAGNETISM OF Ni3Al ALONG TETRAGONAL DEFORMATION PATH
  • THE LOSS OF MAGNETISM OF Ni3Al ALONG TETRAGONAL DEFORMATION PATH (en)
skos:notation
  • RIV/00216224:14310/05:00013243!RIV10-MSM-14310___
http://linked.open...avai/riv/aktivita
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  • P(GA202/03/1351), P(GD106/05/H008), P(IAA1041302), Z(AV0Z20410507), Z(MSM0021622410)
http://linked.open...vai/riv/dodaniDat
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  • 528437
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  • RIV/00216224:14310/05:00013243
http://linked.open...riv/jazykVysledku
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  • electronic structure; magnetism; intermetallic compounds (en)
http://linked.open.../riv/klicoveSlovo
http://linked.open...ontrolniKodProRIV
  • [607FCC7CC7B8]
http://linked.open...v/mistoKonaniAkce
  • Brno
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  • Brno
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  • V. pracovní setkání fyzikálních chemiků a elektrochemiků
http://linked.open...in/vavai/riv/obor
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http://linked.open...vavai/riv/projekt
http://linked.open...UplatneniVysledku
http://linked.open...iv/tvurceVysledku
  • Šob, Mojmír
  • Legut, Dominik
http://linked.open...vavai/riv/typAkce
http://linked.open.../riv/zahajeniAkce
http://linked.open...n/vavai/riv/zamer
number of pages
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  • Masarykova univerzita
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  • 80-210-3637-0
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  • 14310
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