{
    "specific": {
        "adf": {},
        "dftb": {},
        "dirac": {},
        "cp2k" : {
        "motion": {
         "md" : {
                    "thermostat" : {
                         "type": "csvr",
                         "csvr" : {
                             "timecon": 1000
                         }
                    },
                    "ensemble": "NVT",
                    "steps": 5000,
                    "timestep": 1.0,
                    "temperature": 300
                  }
        },
            "force_eval": {
                 "method" : "fist",
                 "mm" :  {
                    "print": {
                       "ff_info" : {}
                    },
                    "neighbor_lists": {
                       "geo_check": ".false."
                       },
                    "forcefield": {
                       "ignore_missing_critical_params": {},
                       "spline": {
                          "emax_spline": 1.0E10,
                          "rcut_nb [angstrom]": 15.0
                          }
                       },
                    "poisson": {
                       "periodic": "none",
                       "poisson_solver": "Analytic",
                       "ewald": {
                          "ewald_type": "spme",
                          "alpha": 0.44,
                          "gmax": 24
                          }
                    }
                 },
                 "subsys": {
                    "cell": {
                       "abc": 40.0,
                       "periodic": "none"
                    },
                    "topology": {
                       "coordinate": "pdb",
                       "coord_file_name" : "",
                       "connectivity": "mol_set",
                       "dump_pdb" : {},
                       "dump_psf" : {},
                       "center_coordinates" : {}
                    }
                 }
              },
              "global": {
                 "print_level": "low",
                 "project": "qmflows-cp2k",
                 "run_type": "md"
              }
           },
        "orca": {},
        "gamess": {}
    }
}