InvDesFlow-AL(candinate-superconductors)

Hsupercon.zip contains all candidate superconducting materials generated by the artificial intelligence model (InvDesFlow). These structures represent potential new superconductors discovered through AI exploration of high-Tc chemical space. intercalated_multinary_hydrides.zip includes DFT-validated and fully relaxed structures of multinary hydride superconductors. The study demonstrates that atomic intercalation can induce phonon softening and enhance electron-phonon coupling, leading to significantly higher superconducting transition temperatures. For example, K₂GaCuH₆ and K₂LiCuH₆ exhibit predicted Tc values of 68 K and 53 K at ambient pressure, respectively—much higher than that of K₂CuH₆ (~18 K). This confirms that atomic intercalation is an effective strategy for discovering high-temperature multinary hydride superconductors.