&control calculation='relax' tefield = .true., / &system ibrav= 1, celldm(1) =10.0, nat=2, ntyp= 2, edir=3 eamp=0.001 emaxpos=0.5 eopreg=0.1 ecutwfc =25, ecutrho =300, / &electrons mixing_beta = 0.5, conv_thr = 1.0d-8 / &ions / ATOMIC_SPECIES O 0.0 O.pz-rrkjus.UPF C 0.0 C.pz-rrkjus.UPF ATOMIC_POSITIONS BOHR O 0.000000000 0.000000000 -1.1 C 0.000000000 0.000000000 1.1 K_POINTS 1 0.0 0.0 0.0 1.0