{"1": { "calculator": "unknown", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [6.957949189355169, -2.50387102247235e-16, 0.0, -4.586513757322305e-16, 6.963137579861323, 0.0, 6.694158848339432e-19, 0.0, 15.377678428384678]]}, "__ase_objtype__": "cell"}, "ctime": 24.89576958416784, "dipole": {"__ndarray__": [[3], "float64", [-2.4276708339229678e-05, -4.773209366719993e-05, -5.745181218792907e-07]]}, "energy": -19.6978741756839, "free_energy": -19.703533633983323, "initial_magmoms": {"__ndarray__": [[6], "float64", [0.0, 0.0, 0.0, 0.0, 0.0, 0.0]]}, "mtime": 24.89576958416784, "numbers": {"__ndarray__": [[6], "int64", [49, 49, 34, 34, 34, 34]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, false]]}, "positions": {"__ndarray__": [[6, 3], "float64", [3.47897493, 1.56e-06, 7.68883733, 6.1e-07, 3.48157036, 7.68883929, 0.8921491, 0.8919907, 7.69106846, 4.37132515, 2.58939339, 7.68631045, 6.0658006, 6.07114946, 7.6866101, 2.58662532, 4.37374708, 7.69136806]]}, "unique_id": "51e6e53215112b4542b7a6a05f350d09", "user": "cmr"}, "ids": [1], "nextid": 2}