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arxiv: 1809.03407 · v1 · pith:NHFLMLNVnew · submitted 2018-08-23 · ❄️ cond-mat.mtrl-sci

Bond relaxation, electronic and magnetic behavior of 2D metals structures Y on Li(110) surface

classification ❄️ cond-mat.mtrl-sci
keywords magneticelectronicadsorptionatomsbehaviorbondmetalsstructures
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We investigated the bond, electronic and magnetic behavior of adsorption Yttrium atoms on Lithium (110) surface using a combination of Bond-order-length-strength(BOLS) correlation and density-functional theory(DFT). We found that adsorption Y atoms on Li(110) surfaces form two-dimensional (2D) geometric structures of hexagon, nonagon, solid hexagonal, quadrangle and triangle. The consistent with the magnetic moment are 6.66{\mu}B, 5.54{\mu}B, 0.28{\mu}B, 1.04{\mu}B, 2.81{\mu}B, respectively. In addition, this work could pave the way for design new 2D metals electronic and magnetic properties.

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