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- W2004807536 abstract "We discuss the role of the classical crossing points of the nonlocal density-functional atomic pseudopotentials in systematizing the crystal structures of all binary $mathrm{AB}$ compounds (with $Aensuremath{ne}B$). We show how these pseudopotential radii ${{r}_{l}}$ can be used to predict the stable crystal structure of all known (565) binary compounds. We discuss the correlation between ${{r}_{l}}$ and semiclassical scales for bonding in solids." @default.
- W2004807536 created "2016-06-24" @default.
- W2004807536 creator A5007886751 @default.
- W2004807536 date "1980-12-15" @default.
- W2004807536 modified "2023-10-16" @default.
- W2004807536 title "Systematization of the stable crystal structure of all<mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML display=inline><mml:mi>AB</mml:mi></mml:math>-type binary compounds: A pseudopotential orbital-radii approach" @default.
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