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000056541 084__ $$2WoS$$aPhysics, Condensed Matter
000056541 1001_ $$0P:(DE-Juel1)130545$$aBihlmayer, G.$$b0$$uFZJ
000056541 245__ $$aEnhanced Rashba spin-orbit splitting in Bi/Ag(111) and Pb/Ag(111) surface alloys from first principles
000056541 260__ $$aCollege Park, Md.$$bAPS$$c2007
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000056541 520__ $$aWe present first-principles calculations of a (root 3x root 3) R30 degrees Bi/Ag (111)-ordered surface alloy, which has recently been investigated experimentally using angle-resolved photoemission spectroscopy. The surface states in the L-projected bulk band gap show a Rashba-type spin-orbit splitting which is three times larger than what has been observed on a clean Bi (111) surface. This large enhancement can be explained by the strong distortion of the surface-state wave function which is caused by the substantial outward buckling of the Bi atom. Also, in a similar surface alloy, Pb/Ag (111), a strong Rashba-type splitting was found by our calculations. The comparison to the experimental data is more difficult due to the presence of a second, close-by surface state. We discuss the dependence of the two-dimensional band structure on the surface corrugation and compare to the experimental findings.
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000056541 7001_ $$0P:(DE-Juel1)130548$$aBlügel, S.$$b1$$uFZJ
000056541 7001_ $$0P:(DE-HGF)0$$aChulkov, E. V.$$b2
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000056541 8567_ $$uhttp://dx.doi.org/10.1103/PhysRevB.75.195414
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