&control calculation = 'scf' title = 'TDDFPT CH4 Test (Environ)' restart_mode='from_scratch', pseudo_dir = '../pseudo', outdir='./out', prefix='CH4' / &system ibrav = 1, celldm(1) = 20, nat = 5, ntyp = 2, ecutwfc = 25, / &electrons diagonalization = 'davidson' mixing_mode = 'plain', conv_thr = 1.0d-8, mixing_beta = 0.7 electron_maxstep = 100 / ATOMIC_SPECIES C 12.001 C.pz-vbc.UPF H 1.008 H.pz-vbc.UPF ATOMIC_POSITIONS {Angstrom} C 0.000000000 0.000000000 0.000000000 H 0.642814093 0.642814093 0.642814093 H -0.642814093 -0.642814093 0.642814093 H 0.642814093 -0.642814093 -0.642814093 H -0.642814093 0.642814093 -0.642814093 K_POINTS {gamma}