&control calculation='nscf' / &system ibrav=2, celldm(1) =7.50, nat=1, ntyp=1, ecutwfc =15.0, occupations='smearing', smearing='marzari-vanderbilt', degauss=0.05 nbnd=4 / &electrons / ATOMIC_SPECIES Al 26.98 Al.pz-vbc.UPF ATOMIC_POSITIONS {alat} Al 0.00 0.00 0.00 K_POINTS {automatic} 6 6 6 1 1 1