&control calculation='md' dt=20, nstep=50 / &system ibrav= 2, celldm(1)=10.18, nat= 2, ntyp= 1, ecutwfc = 8.0, nosym=.true. / &electrons conv_thr = 1.0e-8 mixing_beta = 0.7 / &ions wfc_extrapolation='first_order' / ATOMIC_SPECIES Si 28.086 Si.pz-vbc.UPF ATOMIC_POSITIONS Si -0.123 -0.123 -0.123 Si 0.123 0.123 0.123 K_POINTS {automatic} 1 1 1 0 0 0