&control calculation='scf', restart_mode='from_scratch', prefix='carbon', pseudo_dir = '../../pseudo/', / &system ibrav = 2, celldm(1) =6.74, nat= 2, ntyp= 1, nr1=32, nr2=32, nr3=32, ecutwfc = 27.0 ecutrho = 300.0 / &electrons mixing_beta = 0.7 conv_thr = 1.0d-9 / ATOMIC_SPECIES C 12.0107 C.pz-rrkjus.UPF ATOMIC_POSITIONS (alat) C 0.00 0.00 0.00 C 0.25 0.25 0.25 K_POINTS AUTOMATIC 4 4 4 1 1 1