Dear All, Hi. I could not get the wavefunction squared for a structure which its scf had already calculated with only gamma point with pp.x. I read that plan_avg.x does the same calculation for gamma point, but I have not found its input file. I would appreciate if anybody could either show me a trick to get the wavefunction squared of gamma point with plotnum=7 or plan_avg.x. Thanks in advance. P Shok
- [Pw_forum] plan_avg.x for wavefunction squared calculation pari shok
- [Pw_forum] plan_avg.x for wavefunction squared calcul... Paolo Giannozzi
