&GLOBAL
  PRINT_LEVEL LOW
  PROJECT H2-kubo-gapw
  RUN_TYPE ENERGY
&END GLOBAL

&FORCE_EVAL
  METHOD QS
  &DFT
    BASIS_SET_FILE_NAME BASIS_SET
    POTENTIAL_FILE_NAME POTENTIAL
    &MGRID
      CUTOFF 80
      NGRIDS 4
    &END MGRID
    &QS
      EPS_DEFAULT 1.0E-10
      METHOD GAPW
    &END QS
    &SCF
      EPS_SCF 1.0E-7
      MAX_SCF 30
      SCF_GUESS ATOMIC
      &OT ON
        PRECONDITIONER FULL_ALL
      &END OT
    &END SCF
    &XC
      &XC_FUNCTIONAL PADE
      &END XC_FUNCTIONAL
    &END XC
  &END DFT
  &PROPERTIES
    &KUBO_TRANSPORT ON
      DISSIPATION [K] 300
      ENERGY_RANGE [hartree] -0.35 -0.34
      NEUTRAL_GRID 20
      NEUTRAL_MU [hartree] -0.35
      N_MU 1
      TEMPERATURE [K] 300
    &END KUBO_TRANSPORT
  &END PROPERTIES
  &SUBSYS
    &CELL
      ABC 6.0 6.0 6.0
      PERIODIC NONE
    &END CELL
    &COORD
      H     0.000000     0.000000     0.000000
      H     0.720000     0.000000     0.000000
    &END COORD
    &KIND H
      BASIS_SET DZVP-GTH-PADE
      POTENTIAL GTH-PADE-q1
    &END KIND
  &END SUBSYS
&END FORCE_EVAL
