&GLOBAL
  PROGRAM_NAME ATOM
&END GLOBAL
&ATOM
  ELEMENT C

  RUN_TYPE ENERGY

  ELECTRON_CONFIGURATION  CORE 2s2 2p2
  CORE [He]
  MAX_ANGULAR_MOMENTUM 3

  &METHOD
     METHOD_TYPE  KOHN-SHAM
     &XC
       &XC_FUNCTIONAL PBE
       &END XC_FUNCTIONAL
     &END XC
  &END METHOD

  &PRINT
     &GEOMETRICAL_RESPONSE_BASIS
        NUM_GTO_CORE      6
        NUM_GTO_EXTENDED  4
        EXTENSION_BASIS   0 0
        CONFINEMENT  8.0
        NAME_BODY  GRB-q4
     &END
  &END

  &POTENTIAL
    PSEUDO_TYPE GTH
    &GTH_POTENTIAL
    2    2    0    0
    0.33842037096913       2   -8.80041712690571    1.33249221738633
       1
    0.30268766321861       1    9.60946227253083
    &END
    CONFINEMENT_TYPE  BARRIER
    CONFINEMENT 200. 4.0 12.0
  &END POTENTIAL
  &POWELL
      ACCURACY   1.e-14
      STEP_SIZE  0.20
  &END

&END ATOM
