&GLOBAL
  PRINT_LEVEL LOW
  PROJECT dftb_nonscc_ch2o_x_kp_debug
  RUN_TYPE DEBUG
&END GLOBAL

&DEBUG
  DEBUG_FORCES T
  DEBUG_STRESS_TENSOR T
  DX 0.0001
  EPS_NO_ERROR_CHECK 1.0e-6
  STOP_ON_MISMATCH F
&END DEBUG

#CPQA INCLUDE DFTB/nonscc/ch.spl
#CPQA INCLUDE DFTB/nonscc/hc.spl
#CPQA INCLUDE DFTB/nonscc/co.spl
#CPQA INCLUDE DFTB/nonscc/oc.spl
#CPQA INCLUDE DFTB/nonscc/oh.spl
#CPQA INCLUDE DFTB/nonscc/ho.spl
#CPQA INCLUDE DFTB/nonscc/hh.spl
#CPQA INCLUDE DFTB/nonscc/oo.spl
#CPQA INCLUDE DFTB/nonscc/nonscc_parameter
&FORCE_EVAL
  STRESS_TENSOR DIAGONAL_ANALYTICAL
  &DFT
    &KPOINTS
      FULL_GRID OFF
      SCHEME MONKHORST-PACK 2 1 1
      SYMMETRY ON
      VERBOSE T
    &END KPOINTS
    &QS
      METHOD DFTB
      &DFTB
        DISPERSION F
        ORTHOGONAL_BASIS F
        SELF_CONSISTENT F
        &PARAMETER
          PARAM_FILE_NAME nonscc_parameter
          PARAM_FILE_PATH DFTB/nonscc
          UFF_FORCE_FIELD ../uff_table
        &END PARAMETER
      &END DFTB
    &END QS
    &SCF
      SCF_GUESS NONE
    &END SCF
  &END DFT
  &SUBSYS
    &CELL
      ABC 6.0000000000 18.0000000000 18.0000000000
      PERIODIC X
    &END CELL
    &COORD
      O     0.051368    0.000000    0.000000
      C     1.278612    0.000000    0.000000
      H     1.870460    0.939607    0.000000
      H     1.870460   -0.939607    0.000000
    &END COORD
  &END SUBSYS
&END FORCE_EVAL
