Calculations of Superconducting Properties in Yttrium and Calcium under High Pressure
ORAL
Abstract
We have used first-principles electronic structure calculations to generate the bulk modulus as a function of volume as well as the densities of states and scattering phase shifts at the Fermi level. These quantities were used in conjunction with the rigid-muffin-tin theory of Gaspari and Gyorffy and the McMillan theory to determine the electron-phonon coupling and the superconducting transition temperature for Yttrium and Calcium under high pressures. Our results provide a good interpretation of the measured increase of $T_{c}$ in these metals.
*Supported by the Office of Naval Research.
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