SYSTEM = Untitled (VASP) PREC = High IBRION = 2 NSW = 100 ISIF = 3 ENCUT = 500 NELM = 60 NELMIN = 2 EDIFF = 1.0e-05 EDIFFG = -0.02 ISPIN = 2 LWAVE = .TRUE. LCHARG = .TRUE. ISMEAR = 0 SIGMA = 0.1 IALGO = 38 LREAL = Auto