&GLOBAL
  PROJECT Ce
  PROGRAM_NAME ATOM
&END GLOBAL
&ATOM
  ELEMENT Ce
  ELECTRON_CONFIGURATION [Xe] 4f1 5d1 6s2
  &METHOD
     METHOD_TYPE  KOHN-SHAM
     RELATIVISTIC DKH(3)
     &XC
       &XC_FUNCTIONAL PBE0
       &END XC_FUNCTIONAL
     &END XC
  &END METHOD
  &OPTIMIZATION
    MAX_ITER  12
    DAMPING   0.8
    EPS_DIIS 100.
    N_DIIS 6
  &END OPTIMIZATION

  &AE_BASIS
     BASIS_TYPE  GEOMETRICAL_GTO
     NUM_GTO  10 10 5 5
     GEO_START_VALUE   0.2
     GEOMETRICAL_FACTOR 3.2
     START_INDEX  0 0 4 4
  &END AE_BASIS
&END ATOM
