Efficient <i>ab initio</i> Migdal-Eliashberg calculation considering the retardation effect in phonon-mediated superconductors
Tianchun Wang, Takuya Nomoto, Yusuke Nomura, Hiroshi Shinaoka, Junya Otsuki, Takashi Koretsune, Ryotaro Arita
Abstract
We formulate an efficient scheme to perform a Migdal-Eliashberg calculation considering the retardation effect from first principles. While the conventional approach requires a huge number of Matsubara frequencies, we show that the intermediate representation of the Green's function [H. Shinaoka et al., Phys. Rev. B 96, 035147 (2017)] dramatically reduces the numerical cost to solve the linearized gap equation. Without introducing any empirical parameter, we obtain a superconducting transition temperature of elemental Nb ($\ensuremath{\sim}10$ K), which is consistent with experiment. The present result indicates that our approach has a superior performance for many superconductors for which ${T}_{\mathrm{c}}$ is lower than $O(10)$ K.