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Surface electronic structures of superconducting thin film MgB2(0001)

In Gee Kim, J. I. Lee, B. I. Min, A. J. Freeman

DOI 10.1103/PhysRevB.64.020508 · Physical Review B

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Abstract

The surface electronic structures of superconducting MgB2 were investigated using the all-electron full-potential linearized augmented plane-wave method. Hexagonal (0001) surfaces with both B terminated (B-Term) and Mg terminated (Mg-Term) were considered. Due to the nearly-free-electron nature of the Mg surface layer, the vacuum screening range of Mg-Term is shorter than that of B-Term, which shows the covalent bonding nature of the B surface layer. Considerably enhanced densities of states near the Fermi level are found at the surface layers especially for B-Term, which is expected to yield an enhanced superconductivity in the surface of thin film MgB2 over that in bulk—assuming no large changes in the electron-ion matrix elements and phonon frequency contributions. While this expectation is contrary to the weakened superconductivity observed in surface-oriented experiments, we attribute this discrepancy to extrinsic surface effects.

Source-reported materials — not catalogue approval

FormulaReported Tc (K)Pressure (GPa)Type
MgB2

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39Pressure not reportedunknown

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