&FORCE_EVAL
  METHOD Quickstep
  &DFT
    BASIS_SET_FILE_NAME ../../../data/BASIS_MOLOPT
    POTENTIAL_FILE_NAME ../../../data/POTENTIAL
   
    &MGRID
      CUTOFF 250
      NGRIDS 1
    &END MGRID
    &QS
      EPS_DEFAULT 1.0E-8
    &END QS
    &SCF
      EPS_DIIS 0.1
      EPS_SCF 1.0E-6
      MAX_DIIS 4
      MAX_SCF 100
       
      SCF_GUESS ATOMIC
    &END SCF

    &XC
      &XC_FUNCTIONAL  BEEFVDW
      &END XC_FUNCTIONAL
      &VDW_POTENTIAL
        &NON_LOCAL
            TYPE LMKLL
            KERNEL_FILE_NAME ../../../data/vdW_kernel_table.dat
        &END NON_LOCAL
      &END VDW_POTENTIAL
    &END XC
  &END DFT
  &SUBSYS
    &CELL
      ABC 5.3 5.3 5.3
      ALPHA_BETA_GAMMA 90 90 90
    &END CELL
    &COORD
      SCALED .TRUE.
      Ar 0.0 0.0 0.0
      Ar 0.5 0.5 0.0
    &END COORD
    &KIND Ar
      BASIS_SET DZVP-MOLOPT-SR-GTH-q8
      POTENTIAL GTH-PBE-q8
    &END
  &END SUBSYS
&END FORCE_EVAL

&GLOBAL
  PROJECT H2O
  PRINT_LEVEL MEDIUM
  RUN_TYPE ENERGY_FORCE
&END GLOBAL
