EDIFF = 1e-05
EDIFFG = -0.05
ENCUT = 240
IBRION = 2
ISIF = 3
ISMEAR = 0
ISPIN = 2
LORBIT = 10
NELM = 15
NSW = 25
NUPDOWN = 2
POTIM = 0.1
SIGMA = 0.1
