&GLOBAL
  PRINT_LEVEL LOW
  PROJECT_NAME HF_NATIVE_SKALA_GPW_NLCC_FORCE
  RUN_TYPE ENERGY_FORCE
&END GLOBAL

&FORCE_EVAL
  METHOD Quickstep
  &DFT
    BASIS_SET_FILE_NAME BASIS_MOLOPT
    MULTIPLICITY 1
    POTENTIAL_FILE_NAME NLCC_POTENTIALS
    UKS FALSE
    &MGRID
      CUTOFF 160
      REL_CUTOFF 30
    &END MGRID
    &POISSON
      PERIODIC NONE
      PSOLVER MT
    &END POISSON
    &QS
      EPS_DEFAULT 1.0E-8
      EXTRAPOLATION USE_PREV_WF
      METHOD GPW
    &END QS
    &SCF
      EPS_SCF 1.0E-5
      IGNORE_CONVERGENCE_FAILURE T
      MAX_SCF 1
      SCF_GUESS ATOMIC
      &DIAGONALIZATION
      &END DIAGONALIZATION
    &END SCF
    &XC
      &XC_FUNCTIONAL
        &GAUXC
          MODEL SKALA
          NATIVE_GRID T
          NATIVE_GRID_ATOM_PARTITION SMOOTH
          NATIVE_GRID_DIAGNOSTICS F
        &END GAUXC
      &END XC_FUNCTIONAL
    &END XC
  &END DFT
  &PRINT
    &FORCES ON
    &END FORCES
  &END PRINT
  &SUBSYS
    &CELL
      ABC 6.0 6.0 6.0
      PERIODIC NONE
    &END CELL
    &COORD
      H      3.000000  3.000000  3.470000
      F      3.000000  3.000000  2.490000
    &END COORD
    &KIND H
      BASIS_SET SZV-MOLOPT-SR-GTH
      POTENTIAL GTH-NLCC-PBE-q1
    &END KIND
    &KIND F
      BASIS_SET SZV-MOLOPT-SR-GTH
      POTENTIAL GTH-NLCC-PBE-q7
    &END KIND
  &END SUBSYS
&END FORCE_EVAL
