Untitled

&CONTROL
    calculation   = "vc-relax"
    forc_conv_thr =  1.00000e-03
    max_seconds   =  1.72800e+05
    nstep         = 100
    pseudo_dir    = "C:\Users\chogu\.burai\.pseudopot"
/

&SYSTEM
    a                         =  8.00000e+00
    c                         =  2.00000e+01
    degauss                   =  1.00000e-02
    ecutrho                   =  2.25000e+02
    ecutwfc                   =  2.50000e+01
    ibrav                     = 6
    nat                       = 40
    nspin                     = 2
    ntyp                      = 5
    occupations               = "smearing"
    smearing                  = "gaussian"
    starting_magnetization(1) =  2.00000e-01
    starting_magnetization(2) =  2.00000e-01
    starting_magnetization(3) =  2.00000e-01
    starting_magnetization(4) =  2.00000e-01
    starting_magnetization(5) =  0.00000e+00
/

&ELECTRONS
    conv_thr         =  1.00000e-06
    electron_maxstep = 200
    mixing_beta      =  4.00000e-01
    startingpot      = "atomic"
    startingwfc      = "atomic+random"
/

&IONS
    ion_dynamics = "bfgs"
/

&CELL
    cell_dofree    = "all"
    cell_dynamics  = "bfgs"
    press          =  0.00000e+00
    press_conv_thr =  5.00000e-01
/

K_POINTS {automatic}
 2  2  1  0 0 0

ATOMIC_SPECIES
Fe     55.84500  Fe.pbe-nd-rrkjus.UPF
Cr     51.99610  Cr.pbe-sp-van.UPF
Co     58.93320  Co.pbe-nd-rrkjus.UPF
Ni     58.69340  Ni.pbe-nd-rrkjus.UPF
Al     26.98154  Al.pbe-rrkj.UPF

ATOMIC_POSITIONS {angstrom}
Fe      2.000000   2.000000   2.000000
Fe      2.000000   2.000000  14.000000
Fe      2.000000   6.000000  10.000000
Fe      4.000000   4.000000  12.000000
Fe      4.000000   0.000000   4.000000
Fe      6.000000   2.000000   2.000000
Fe      6.000000   6.000000  10.000000
Fe      0.000000   4.000000   8.000000
Cr      2.000000   2.000000  10.000000
Cr      2.000000   6.000000   2.000000
Cr      4.000000   0.000000   8.000000
Cr      4.000000   0.000000  16.000000
Cr      6.000000   2.000000  14.000000
Cr      6.000000   2.000000  18.000000
Cr      0.000000   4.000000  12.000000
Cr      0.000000   0.000000  12.000000
Co      2.000000   2.000000   6.000000
Co      2.000000   6.000000   6.000000
Co      2.000000   6.000000  18.000000
Co      4.000000   4.000000   4.000000
Co      4.000000   4.000000  16.000000
Co      6.000000   2.000000  10.000000
Co      0.000000   4.000000   0.000000
Co      0.000000   0.000000   0.000000
Ni      2.000000   2.000000  18.000000
Ni      4.000000   4.000000   8.000000
Ni      6.000000   2.000000   6.000000
Ni      6.000000   6.000000   2.000000
Ni      6.000000   6.000000   6.000000
Ni      6.000000   6.000000  14.000000
Ni      0.000000   4.000000   4.000000
Ni      0.000000   4.000000  16.000000
Al      2.000000   6.000000  14.000000
Al      4.000000   4.000000   0.000000
Al      4.000000   0.000000  12.000000
Al      4.000000   0.000000   0.000000
Al      6.000000   6.000000  18.000000
Al      0.000000   0.000000   4.000000
Al      0.000000   0.000000   8.000000
Al      0.000000   0.000000  16.000000