&CONTROL pseudo_dir = '.' / &SYSTEM ibrav = 2 A = 2.863 nat = 1 ntyp = 1 ecutwfc = 18.0 occupations = 'smearing' degauss = 0.1d0 / &ELECTRONS / ATOMIC_SPECIES Al 26.982 Al.pz-vbc.UPF ATOMIC_POSITIONS crystal Al 0.00 0.00 0.00 K_POINTS automatic 8 8 8 1 1 1