Physics – Condensed Matter – Superconductivity
Scientific paper
2001-03-27
Phys. Rev. Lett 87, 087005 (2001)
Physics
Condensed Matter
Superconductivity
4 pages, 3 figures
Scientific paper
10.1103/PhysRevLett.87.087005
Density-functional calculations of the phonon spectrum and electron-phonon coupling in MgB$_2$ are presented. The $E_{2g}$ phonons, which involve in-plane B displacements, couple strongly to the $p_{x,y}$ electronic bands. The isotropic electron-phonon coupling constant is calculated to be about 0.8. Allowing for different order parameters in different bands, the superconducting $\lambda$ in the clean limit is calculated to be significantly larger. The $E_{2g}$ phonons are strongly anharmonic, and the non-linear contribution to the coupling between the $E_{2g}$ modes and the p$_{x,y}$ bands is significant.
Kortus Jens
Liu Amy Y.
Mazin Igor I.
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