Dear all, During the post-process, psi^2 projected on a certain band is necessary for us. However, pp.x with plot_num=7 gives such image on gamma point only. My question is: if a certain band is much localized (such as the 3d states in some transition metal oxide or localized donor states in the semiconductor gap), does psi^2 on gamma represent the spatial charge distribution of the whole localized band?
Best wishes
Shujun
