{"1": { "calculator": "unknown", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [3.6835855808872093, 1.7314833172125693e-18, 0.0, 2.798110324307331e-16, 4.775664558441452, 0.0, 1.35981683248266e-18, 0.0, 17.419999999999998]]}, "__ase_objtype__": "cell"}, "ctime": 24.687563199988805, "dipole": {"__ndarray__": [[3], "float64", [-1.1740257461653577e-14, 2.9153724790568623, -7.897531590574252e-14]]}, "energy": -18.48505772938068, "free_energy": -18.485060678565954, "initial_magmoms": {"__ndarray__": [[4], "float64", [0.0, 0.0, 0.0, 0.0]]}, "mtime": 24.687563199988805, "numbers": {"__ndarray__": [[4], "int64", [33, 33, 33, 33]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, false]]}, "positions": {"__ndarray__": [[4, 3], "float64", [0.0, 0.05604514, 9.90939638, 0.0, 4.1465389, 7.51060294, 1.84179279, 2.44387742, 7.51060362, 1.84179279, 1.75870662, 9.90939706]]}, "tags": {"__ndarray__": [[4], "int32", [0, 0, 0, 0]]}, "unique_id": "238ecb3a90618f00559a112ce0a65494", "user": "cmr"}, "ids": [1], "nextid": 2}