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SYSTEM     =  PbTiO3
ENCUT    = 650.0      ! in eV
ISMEAR  = 0         
SIGMA   = 0.02      
ICHARG = 11
LBERRY = .TRUE.
IGPAR = 1£¨2/3£©
NPPSTR = 8
DIPOL = 0.25 0.25 0.25
EDIFF=1E-6
NELM=150
LWAVE=.FALSE.
  PREC=Accurate
IBRION  = 2     
ISIF    = 2      
EDIFFG  = -0.003
NPAR = 4
LREAL= Auto
ADDGRID = .TRUE.
LASPH   = .TRUE.
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