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This is taken to be 1.8 bohrs, measured between the center of the Br atom and the positive-background edge of the uniform-background (jellium) model representing each electrode. It is obtained by using the layer spacing for Br adsorbed on Cu(111) determined by M. F. Kadodwala, A. A. Davis, G. Scragg, B. C. C. Cowie, M. Kerkar, D. P. Woodruff and R. G. Jones, Surf. Sci. 324, 122 (1995), together with the fact that the positive-background edge of a jellium is half an interlayer spacing outside of the center of the outermost layer of the metal it represents (neglecting contractions or expansions of the layer spacing at the surface).
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