{"1": { "calculator": "unknown", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [3.6099164485941353, -3.575018420832909e-16, 0.0, -1.804958222235026, 4.150470076197382, 0.0, -2.017414228107459e-16, 0.0, 18.85580293064]]}, "__ase_objtype__": "cell"}, "ctime": 24.994093229294656, "dipole": {"__ndarray__": [[3], "float64", [-3.5848431453510488, -3.688599770041974, 4.79060170554698e-05]]}, "energy": -23.056229292549762, "free_energy": -23.060050209399282, "initial_magmoms": {"__ndarray__": [[4], "float64", [0.0, 0.0, 0.0, 0.0]]}, "mtime": 24.994093229294656, "numbers": {"__ndarray__": [[4], "int64", [53, 53, 41, 41]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, false]]}, "positions": {"__ndarray__": [[4, 3], "float64", [-0.00126078, 0.05543481, 7.17921392, 0.00126125, 2.7115697, 11.6781239, 0.00071723, 0.1097458, 10.04005036, -0.00071669, 2.65723165, 8.81777455]]}, "tags": {"__ndarray__": [[4], "int32", [0, 0, 0, 0]]}, "unique_id": "fd007aee244a9d9a5d9ede6ece2d9f3a", "user": "cmr"}, "ids": [1], "nextid": 2}