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19972026
most citedFirst principles study of adsorbed Cu_n (n=1-4) microclusters on MgO(100): structural and electronic properties

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cond-mat.mtrl-sci1997★ 137 cited

First principles study of adsorbed Cu_n (n=1-4) microclusters on MgO(100): structural and electronic properties

V. Musolino, A. Selloni, R. Car

We present a density functional study of the structural and electronic properties of small Cu_n (n=1,4) aggregates on defect-free MgO(100). The calculations employ a slab geometry…