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arxiv: 0801.1242 · v1 · submitted 2008-01-08 · ❄️ cond-mat.mtrl-sci · cond-mat.str-el

Orbital moment of a single Co atom on a Pt(111) surface - a view from correlated band theory

classification ❄️ cond-mat.mtrl-sci cond-mat.str-el
keywords orbitalmomentsurfaceadatomagreementatombandcalculated
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The orbital magnetic moment of a Co adatom on a Pt(111) surface is calculated in good agreement with experimental data making use of the LSDA+U method. It is shown that both electron correlation induced orbital polarization and structural relaxation play essential roles in orbital moment formation. The microscopic origins of the orbital moment enhancement are discussed.

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