Theory of unconventional magnetism in a Cu-based kagome metal

This dataset contains computational input and output files used in the study of the pristine, twisted, and breathing configurations of CsCu₃Cl₅. It includes DFT input files for all three configurations, Wannier90 input and output data for the pristine and twisted structures, and cRPA input data for the pristine and twisted configurations. The files allow reproduction of the results discussed in the corresponding publication, obtained through DFT calculations followed by Wannierization and constrained RPA analysis. This work was also supported by QUAST, FOR 5249-449872909 (Project 3).