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Liu, Feng | Magnetism of Al-Mn quasicrystals | The effect of symmetry and concentration of Mn on the magnetism of Al-Mn quasicrystals has been investigated through self-consistent density-functional calculations using molecular clusters and supercell band-structure schemes. A single Mn atom surrounded by 54 Al atoms in an icosahedral or a cuboct... | Al-Mn quasicrystals; Self-consistent; Density-functional calculations | 1993-07 |