Folder 'cell_setting' contains information on the settings of the unit cell used for the computations and as reported in the literature and how they relate to each other
Folder 'Ucalc' contains the input and output files for the self consitent DFT+U calculations, as well as the convergence testing of the q-mesh
Folder 'Pseudopoential' contains the pseudopotentials used in this work
Folder 'phonon' contains the phonon calculation at the gamma point 
convergence_testing.txt contains information on the convergence testing of the plane wave cut off as well as k-points