Pressure effects on the electronic structure, phonons, and superconductivity of noncentrosymmetric ThCoC2

Abstract

The electronic structure, phonons, electron-phonon coupling, and superconductivity are theoretically studied in noncentrosymmetric superconductor ThCoC2 as a function of pressure, in the pressure range 0 -20 GPa. We found that the electronic band splitting induced by the spin-orbit coupling is enhanced under pressure. In spite of the overall stiffening of the crystal lattice, the electron-phonon coupling constant λ increases with pressure, from 0.583 at 0 GPa to 0.652 at 20 GPa. If the isotropic Eliashberg electron-phonon coupling theory is used to simulate the effect on the critical temperature Tc, such an increase in λ results in a substantial increase of Tc from 2.5 K at 0 GPa to 4 K at 20 GPa. This shows that examining the effect of pressure offers a chance to resolve the pairing mechanism in ThCoC2.