Startparameter for this run
NWRITE =      2
ISTART =      1
GGA= PE
ISPIN = 2
LORBIT = 11
ISMEAR= 0
NELMDL = -10
LWAVE = .FALSE.
LCHARG = .FALSE.

Electronic Relaxation
ENCUT  = 450
EDIFF  = 1E-06
LREAL=Auto
NELM=300
MAGMOM = 3*0.1 1*5.0 53*0.1
NUPDOWN = 1

LDAU  = .TRUE.
LASPH = .TRUE.

LDAUL = 2 -1 -1 -1
LDAUU = 4.5 0.0 0.0 0.0
LDAUJ = 1.0 0.0 0.0 0.0

Ionic relaxation
IBRION = 2
NSW=200
EDIFFG= -0.030
POTIM=0.1

Electronic relaxation 2 (details)
ALGO = Fast
SIGMA = 0.10

LDIPOL = .False.

LVDW = .TRUE.

