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• W2055758670 endingPage "3782" @default.
• W2055758670 startingPage "3773" @default.
• W2055758670 abstract "We have measured the adsorption geometry for the (2ifmmodetimeselsetexttimesfi{}2)S/Cu(001) surface, including the reconstruction and relaxation of the copper substrate. Multiple-scattering spherical-wave calculations were compared with angle-resolved-photoemission extended-fine-structure data and these results were then compared with a Fourier analysis of the data. The sulfur atoms are located in the fourfold hollow site, with a S--Cu bond distance of 2.26(1) Ar{}. With (1/4) monolayer ``p(2ifmmodetimeselsetexttimesfi{}2)'' sulfur coverage the symmetry of the copper substrate is necessarily lowered from (1ifmmodetimeselsetexttimesfi{}1) to (2ifmmodetimeselsetexttimesfi{}2). Accordingly, the sulfur adsorption induces reconstruction and relaxation of the two topmost Cu layers. All the movement occurs in ${mathrm{Cu}}_{5}$S moieties, as if the surface were forming ${mathrm{Cu}}_{5}$S clusters embedded in the bulk. The first-layer Cu atoms are shifted ensuremath{approxeq}0.06 Ar{} towards the third Cu layer and 0.05(2) Ar{} laterally towards S. The second-layer Cu atoms under S atoms mimic the surface texture, in that they are 0.13 Ar{} farther from the third layer than the bulk spacing would predict. Second-layer Cu atoms under fourfold open sites are close to positions predicted by the bulk spacing. Details of the data analysis and extraction of surface-structural parameters are presented." @default.
• W2055758670 created "2016-06-24" @default.
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• W2055758670 date "1987-03-15" @default.
• W2055758670 modified "2023-09-25" @default.
• W2055758670 title "Geometry of (22)S/Cu(001) determined with use of angle-resolved-photoemission extended fine structure" @default.
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• W2055758670 doi "https://doi.org/10.1103/physrevb.35.3773" @default.
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