 SYSTEM =  qvasp 

INCAR-basic
   PREC   = Normal
   ENCUT  = 500 eV
   NELMIN= 5
   LREAL = F

#   ALGO = Fast
   EDIFF  = 1E-5
#  ISMEAR = 0
   SIGMA = 0.2
   NPAR = 8     ## Important to reduce calculate time, equal sqrt(cpu cores)

#   LDAU=.TRUE.  ## For LDA + U set
#   LDAUTYPE=2
#   LDAUL=2 -1
#   LDAUU=3  0
#   LDAUJ=0  0

   ISPIN = 1    ## For magnetism set
#  MAGMOM = 3*1
 Ionic Relaxation
   ICHARG = 2
   EDIFFG = -0.03        force
   NSW    = 300          max steps for IOM
   IBRION = 2
   POTIM = 0.5
   ISIF   = 3            suface:2 crystal:3
   PSTRESS= 0
   LCHARG = .FALSE.
   LWAVE  =  F

# Use 'qvasp -cif' to transer format (VESTA or MS)
