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• W2040808464 abstract "The atomic and electronic structures of the alkali-metal (Na, K)-adsorbed Si(111)-(3ifmmodetimeselsetexttimesfi{}1) surface are studied by the pseudopotential density-functional total-energy scheme for the structural models proposed to date: the missing-top-layer (MTL), ensuremath{pi}-bonded chain, and overlayer models including their variations. From the extensive investigation of them, we propose the MTL model as the ground-state structure of this system based both on the energetics and on the comparison of the calculated electronic structures with recent angle-resolved ultraviolet photoemission data. textcopyright{} 1996 The American Physical Society." @default.
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• W2040808464 date "1996-09-15" @default.
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• W2040808464 title "Buckled reconstruction of the alkali-metal (Na, K)-adsorbed Si(111)-(3×1) surfaces" @default.
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• W2040808464 doi "https://doi.org/10.1103/physrevb.54.8196" @default.
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