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- W2013800103 abstract "First-principles calculations based on density functional theory are used to determine the structural, lattice dynamical, elastic, and thermodynamical properties of magnetic ${mathrm{CuFeS}}_{2}$. The theoretical results are compared with available experimental data and are used as a basis to critically discuss existing discrepancies between theory and experiment as well as of inconsistencies between experimental data." @default.
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- W2013800103 date "2004-11-10" @default.
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- W2013800103 title "<i>Ab initio</i>characterization of magnetic<mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML display=inline><mml:mrow><mml:msub><mml:mi>CuFeS</mml:mi><mml:mn>2</mml:mn></mml:msub></mml:mrow></mml:math>" @default.
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- W2013800103 doi "https://doi.org/10.1103/physrevb.70.195206" @default.
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