{"1": { "calculator": "unknown", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [3.7629432329959673, -5.0475812617950844e-20, 0.0, -1.8814716143485308, 3.2598902623925428, 0.0, -1.0636247485156836e-18, 0.0, 18.85580293064]]}, "__ase_objtype__": "cell"}, "ctime": 24.891450489587612, "dipole": {"__ndarray__": [[3], "float64", [-2.734473015416219, 1.5706806773994029, -5.2886011378600754e-05]]}, "energy": -14.660110664302849, "free_energy": -14.674367178614835, "initial_magmoms": {"__ndarray__": [[4], "float64", [0.0, 0.0, 0.0, 0.0]]}, "mtime": 24.891450489587612, "numbers": {"__ndarray__": [[4], "int64", [34, 34, 29, 29]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, false]]}, "positions": {"__ndarray__": [[4, 3], "float64", [-3.862e-05, 0.00015292, 7.64814678, 3.868e-05, 2.17310735, 11.20944913, -0.00028776, 0.0003168, 10.15249013, 0.00028792, 2.17294329, 8.70412381]]}, "tags": {"__ndarray__": [[4], "int32", [0, 0, 0, 0]]}, "unique_id": "d3da651c349c854a20061728a2f5ddf6", "user": "cmr"}, "ids": [1], "nextid": 2}