&control calculation='scf' / &system ibrav= 2, celldm(1) =6.67296786, nat=1, ntyp=1 nbnd = 50 ecutwfc = 35.0, ecutrho = 300.0, occupations='smearing', smearing='methfessel-paxton', degauss=0.01 input_dft='sla+pw+q2dx+q2dc' / &electrons conv_thr = 1.0d-7 mixing_beta = 0.3 / ATOMIC_SPECIES Cu 103.1 Cu.pz-d-rrkjus.UPF ATOMIC_POSITIONS (crystal) Cu 0.00 0.00 0.00 K_POINTS {automatic} 10 10 10 0 0 0