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- W2068793322 abstract "It was shown decades ago within the jellium model that the redistribution of the itinerant electrons at a simple metal surface results in damped electron density oscillations propagating into the bulk (Friedel oscillations). Using self-consistent density-functional theory calculations, we show that pronounced Friedel oscillations still exist at such surfaces even when the effects of the ionic cores are included explicitly. Our findings not only confirm a long-standing and widespread speculation, but further provide a simple physical picture for yet another common phenomenon in lattice relaxation: The Fridel oscillations in electron density contribute to drive the ions to relax in an oscillatory fashion, as evidenced by a corroborative comparison between theory and experiment for $mathrm{Mg}(101ifmmodebarelsetextasciimacronfi{}0).$" @default.
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- W2068793322 date "1999-01-15" @default.
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- W2068793322 title "Oscillatory lattice relaxation at metal surfaces" @default.
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- W2068793322 doi "https://doi.org/10.1103/physrevb.59.1677" @default.
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