SYSTEM = LaSn5
ISTART = 0
ICHARG = 2
ISMEAR = 1
PREC = Accurate
LREAL = Auto
ADDGRID = .TRUE.

# TESTY
ENCUT = 870
KSPACING = 0.1
SIGMA = 0.095

# ELEKTRONOVÝÝ KROK
NELM = 299
NELMIN = 3
NELMDL = -5

EDIFF = 1.E-8
ALGO = Normal

# RELAXACE
IBRION = 1
NSW = 300
ISIF = 3
#relaxace pozice tvaru i objemu

POTIM = 0.04
EDIFFG = -1.E-5

# MAGNETISMUS
#ISPIN = 1
#MAGMOM =

LORBIT = 10
# potrebuju pro doscar

#LELF = .TRUE.
# generuje elfcar
