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- W1999072324 abstract "The electron charge density around an isolated Al nucleus in Al has been calculated self-consistently in the density functional formalism by incorporating the effect of the lattice structure through the spherical solid model. Ab initio pseudopotentials and interionic potentials were calculated from the induced charge densities. These results were used in the calculation of the binding energy of the electron, phonon dispersion curves and elastic constants. Comparison of these results with experiment and jellium theory, where lattice effects are ignored entirely, reveals the importance of multiion interaction, volume dependence and nonlocality on the interionic potentials and lattice properties." @default.
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- W1999072324 date "1984-09-01" @default.
- W1999072324 modified "2023-09-26" @default.
- W1999072324 title "Charge densities, interionic potentials and phonon frequencies in Al" @default.
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- W1999072324 doi "https://doi.org/10.1088/0305-4608/14/9/009" @default.
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