 &control
    calculation='scf'
    restart_mode='from_scratch',
    prefix='Al'
    pseudo_dir = '/scratch/timrov/WORK_Hubbard/Z_git/work2_QE_fork/q-e/pseudo/'
    outdir='/scratch/timrov/WORK_Hubbard/Z_git/work2_QE_fork/q-e/tempdir/'
 /
 &system
    ibrav = 2,
    celldm(1) = 7.60,
    nat = 1,
    ntyp = 1,
    ecutwfc = 16.0,
    occupations = 'smearing',
    smearing = 'mv',
    degauss = 0.02
 /
 &electrons
    conv_thr =  1.0d-10
 /
ATOMIC_SPECIES
Al  26.98   Al.pz-vbc.UPF
ATOMIC_POSITIONS {alat}
Al 0.00 0.00 0.00
K_POINTS {automatic}
3 3 3 1 1 1
