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- W2022378918 endingPage "4589" @default.
- W2022378918 startingPage "4579" @default.
- W2022378918 abstract "The electronic properties of hexagonal graphite have been studied in the framework of the density-functional technique, using nonlocal ionic pseudopotentials and a large number of plane waves. The valence charge density and the density of states are presented, as well as the band structure and the charge-density contributions of some typical wave functions. The electronic energies, at the Fermi level, are parametrized by the Slonczewski-Weiss-McClure model, and compared with the parametrization of experimental data. The numerical accuracy of the calculation has been controlled, in order to provide a reliable comparison between theory and experiment. In particular, the agreement obtained in the framework of the density-functional theory for electronic energies at the Fermi level is surprisingly good." @default.
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- W2022378918 date "1991-02-15" @default.
- W2022378918 modified "2023-09-27" @default.
- W2022378918 title "First-principles study of the electronic properties of graphite" @default.
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- W2022378918 doi "https://doi.org/10.1103/physrevb.43.4579" @default.
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