&control
    calculation = 'scf'
    restart_mode='from_scratch',
    prefix='asymm',
    tstress = .true.
    tprnfor = .true.
    pseudo_dir = '/home/jyhuang/WS_QE/pseudo',
    outdir='/home/jyhuang/WS_QE/scratch/tmp-asy'
 /
 &system
    ibrav=  6,  nat=  5, ntyp= 3,celldm(1)=7.47058, celldm(3)=1.02355
    ecutwfc =30.0, ecutrho=240.0,
    occupations='fixed',nbnd=20
 /
 &electrons
    mixing_mode = 'plain'
    mixing_beta = 0.7
    conv_thr =  1.0d-8
 /
 &ions
 /
 &cell
 /

ATOMIC_SPECIES
Ba    137.34	Ba.pbe-nsp-van.UPF 
Ti    47.90     Ti.pbe-sp-van_ak.UPF
O     16.0      O.pbe-rrkjus.UPF

ATOMIC_POSITIONS (crystal)
Ba       0.000000000   0.000000000   0.020474751
Ti       0.500000000   0.500000000   0.530412725
O        0.500000000   0.500000000  -0.015431644
O        0.500000000   0.000000000   0.492272084
O        0.000000000   0.500000000   0.492272084

K_POINTS {automatic}
5 5 5  0 0 0