#CPQA DEPENDS 2H2O_bsse.inp

&FORCE_EVAL
  METHOD Quickstep
  &BSSE
    &FRAGMENT
      LIST 1 2 3
    &END FRAGMENT
    &FRAGMENT
      LIST 4 5 6
    &END FRAGMENT
  &END BSSE
  &DFT
    BASIS_SET_FILE_NAME ../../../data/BASIS_SET
    POTENTIAL_FILE_NAME ../../../data/POTENTIAL
    &MGRID
      CUTOFF 50
    &END MGRID
    &QS
      EPS_DEFAULT 1.0E-8
    &END QS
    &SCF
      EPS_SCF 1.0E-4
      MAX_SCF 3
      SCF_GUESS ATOMIC
    &END SCF
    &XC
      &XC_FUNCTIONAL Pade
      &END XC_FUNCTIONAL
    &END XC
  &END DFT
  &SUBSYS
    &CELL
      ABC 10.0 10.0 10.0
    &END CELL
    &COORD
   O     0.000000     0.000000     0.000000    H2O1
   H     0.000000     0.000000     1.000000    H2O1
   H     0.942809     0.000000    -0.333333    H2O1
   O    -1.617979    -0.948062    -2.341650    H2O2
   H    -2.529195    -1.296822    -2.122437    H2O2
   H    -1.534288    -0.833088    -3.331486    H2O2
    &END COORD
    &KIND H_ghost
      BASIS_SET DZVP-GTH-PADE
      GHOST
    &END KIND
    &KIND O_ghost
      BASIS_SET DZVP-GTH-PADE
      GHOST
    &END KIND
    &KIND H
      BASIS_SET DZVP-GTH-PADE
      POTENTIAL GTH-PADE-q1
    &END KIND
    &KIND O
      BASIS_SET DZVP-GTH-PADE
      POTENTIAL GTH-PADE-q6
    &END KIND
  &END SUBSYS
&END FORCE_EVAL
&GLOBAL

  PROJECT H2O
  RUN_TYPE BSSE
  PRINT_LEVEL LOW
&END GLOBAL
&EXT_RESTART
  RESTART_FILE_NAME H2O_BSSE-1_2.restart
  RESTART_BSSE
&END
