[Pw_forum] problem in spin configuration

Dear All, I am trying to relax CoMnP unit cell using hubbard_U. But from output file it is showing Co is d10. So it is in -1 state. Mn is showing d5 system. So it is in +2 state. But bader charge analysis is showing Co, Mn and P in 0, +1 and -1 state respectively(showing17.1050 valence

[Pw_forum] problem in spin configuration

Dear All, I am trying to relax CoMnP unit cell using hubbard_U. But from output file it is showing Co is d10. So it is in -1 state. Mn is showing d5 system. So it is in +2 state. But bader charge analysis is showing Co, Mn and P in 0, +1 and -1 state respectively(showing17.1050 valence