SuperBand: an Electronic-band and Fermi surface structure database of superconductors

In comparison to simpler data such as chemical formulas and lattice structures, electronic band structure data provide a more fundamental and intuitive insight into superconducting phenomena. In this work, we generate superconductor's lattice structure files optimized for density functional theory (DFT) calculations. Through DFT, we obtain electronic band for superconductors, including band structures, density of states (DOS), and Fermi surface data. Additionally, we outline efficient...