Sorry, could you please explain this part in some more detail?
2007/2/2, Fabio Bernardini <[EMAIL PROTECTED]>:
Hello In version 2.0 it seems there is a bug in Bands.F file. When you run a spin polarized bandstructure the values for the fermi energy in the first line of .bands are wrong. I think that the problem is in bands.F 475 C Write Fermi energy 476 if(nspin .eq. 2) then WRONG ? 477 write(iu,*) efs(1)/eV,efs(2)/eV 478 else 479 write(iu,*) ef/eV 480 endif I fixed the problem by in the following way 475 C Write Fermi energy 476 if((nspin .eq. 2).and.(fixspin)) then 477 write(iu,*) efs(1)/eV,efs(2)/eV 478 else 479 write(iu,*) ef/eV 480 endif Fabio
