SYSTEM=H2O small OER teaching
ENCUT=520
EDIFF=1e-6
EDIFFG=-.02
PREC=Accurate
LREAL=.FALSE.
LASPH=.TRUE.
ISYM=0
NSW=100
IBRION=2
ISIF=2
POTIM=.3
ISTART=0
ICHARG=2
LWAVE=.TRUE.
LCHARG=.FALSE.
LH5=.FALSE.
ISMEAR=0
SIGMA=.05
ALGO=Normal
NELM=160
ISPIN=1
NBANDS=16
