&CONTROL
   verbosity        = 'high'
   tstress          = .true.
   tprnfor          = .true.
   outdir           = '/var/www/html/data/material-modeling/1000053.cif-QuantumEspresso-herculesd-20250827-120336'
   pseudo_dir       = '/usr/share/espresso/pseudo'
/
&SYSTEM
   ecutwfc          = 20.0
   occupations      = 'smearing'
   degauss          = 0.009558823529411765
   smearing         = 'methfessel-paxton'
   ntyp             = 2
   nat              = 2
   ibrav            = 0
/
&ELECTRONS
   conv_thr         = 1e-05
   mixing_beta      = 0.7
   diagonalization  = 'david'
/
&IONS
/
&CELL
/

ATOMIC_SPECIES
Mg 24.305 Mg.pbe-n-kjpaw_psl.0.3.0.UPF
O 15.999 O.pbe-n-kjpaw_psl.0.1.UPF

K_POINTS automatic
4 4 4  0 0 0

CELL_PARAMETERS angstrom
0.00000000000000 2.10850000000000 2.10850000000000
2.10850000000000 0.00000000000000 2.10850000000000
2.10850000000000 2.10850000000000 0.00000000000000

ATOMIC_POSITIONS angstrom
Mg 0.0000000000 0.0000000000 0.0000000000 
O 2.1085000000 2.1085000000 2.1085000000