 &control
    calculation='scf',
 /
 &system
    ibrav=  3, celldm(1)=5.406, nat=  1, ntyp= 1,
    ecutwfc = 40.0d0, ecutrho = 400.0d0,
    occupations='smearing', smearing='mv', degauss=0.01d0,
    nspin=2, 
    input_dft = 'M06L'
    starting_magnetization(1)= 0.3
 /
 &electrons
 conv_thr = 1.D-7,
 mixing_beta = 0.3,
 diago_david_ndim=4
 /
ATOMIC_SPECIES
 Fe  1.  Fe.pbe-mt_fhi.UPF
ATOMIC_POSITIONS crystal
 Fe 0.0  0.0  0.0 
K_POINTS automatic
13 13 13 0 0 0
