{"1": { "calculator": "gpaw", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [4.1, 0.0, 0.0, 0.0, 4.1, 0.0, 0.0, 0.0, 28.7]]}, "__ase_objtype__": "cell"}, "ctime": 24.89171869894773, "dipole": {"__ndarray__": [[3], "float64", [-24.4879486, -25.57356571, -24.93955188]]}, "energy": -277.792564, "initial_charges": {"__ndarray__": [[35], "float64", [0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]]}, "mtime": 24.89171869894773, "numbers": {"__ndarray__": [[35], "int64", [56, 50, 8, 8, 8, 56, 50, 8, 8, 8, 56, 50, 8, 8, 8, 56, 73, 7, 8, 8, 56, 73, 7, 8, 8, 56, 73, 7, 8, 8, 56, 73, 7, 8, 8]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]}, "positions": {"__ndarray__": [[35, 3], "float64", [0.0, 0.0, 0.0, 2.05, 2.05, 2.05, 2.05, 0.0, 2.05, 2.05, 2.05, 0.0, 0.0, 2.05, 2.05, 0.0, 0.0, 4.1, 2.05, 2.05, 6.15, 2.05, 0.0, 6.15, 2.05, 2.05, 4.1, 0.0, 2.05, 6.15, 0.0, 0.0, 8.2, 2.05, 2.05, 10.25, 2.05, 0.0, 10.25, 2.05, 2.05, 8.2, 0.0, 2.05, 10.25, 0.0, 0.0, 12.3, 2.05, 2.05, 14.35, 2.05, 0.0, 14.35, 2.05, 2.05, 12.3, 0.0, 2.05, 14.35, 0.0, 0.0, 16.4, 2.05, 2.05, 18.45, 2.05, 0.0, 18.45, 2.05, 2.05, 16.4, 0.0, 2.05, 18.45, 0.0, 0.0, 20.5, 2.05, 2.05, 22.55, 2.05, 0.0, 22.55, 2.05, 2.05, 20.5, 0.0, 2.05, 22.55, 0.0, 0.0, 24.6, 2.05, 2.05, 26.65, 2.05, 0.0, 26.65, 2.05, 2.05, 24.6, 0.0, 2.05, 26.65]]}, "unique_id": "7269f9d1626299270709bfd870cbba7e", "user": "cmr"}, "ids": [1], "nextid": 2}