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- W2000375346 abstract "The electronic structure and cohesive properties (including equilibrium lattice constant, bulk modulus, and formation energy) of the intermetallic compounds ${mathit{A}}_{3}$Ti (A=Fe, Co, Ni, and Cu) in their L${1}_{2}$, D${0}_{24}$, and D${0}_{22}$ structures have been studied by means of the self-consistent total-energy linear-muffin-tin-orbital method based on the local-density approximation. The correct phase preference (or stability) of these compounds is obtained. The correlation between the electronic concentration ${mathit{c}}_{mathit{e}}$ (defined as the number of electrons per atom) and the crystal structure found by Beck, Sinha, and Liu can be interpreted in terms of the filling of bonding states in a specific structure showing that the structural stability of ${mathit{A}}_{3}$Ti is predominantly governed by its electron packing in reciprocal space." @default.
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- W2000375346 date "1993-08-15" @default.
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- W2000375346 title "Electronic structure and phase stability of<mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML display=inline><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant=italic>A</mml:mi></mml:mrow><mml:mrow><mml:mn>3</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>Ti (<i>A</i>=Fe, Co, Ni, and Cu)" @default.
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- W2000375346 doi "https://doi.org/10.1103/physrevb.48.4276" @default.
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