{"1": { "calculator": "unknown", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [4.633944756346916, -0.40462964998040246, 0.0, -0.4046296499803958, 4.633944756346823, 0.0, -1.559809579886708e-16, 7.440424933916081e-18, 33.813844]]}, "__ase_objtype__": "cell"}, "ctime": 24.891818716252992, "dipole": {"__ndarray__": [[3], "float64", [6.870544698047906e-15, -7.982694795131718e-14, 4.850469089356093e-13]]}, "energy": -11.004049127790303, "forces": {"__ndarray__": [[4, 3], "float64", [-0.0, 0.0, 0.00658524, -0.0, -0.0, -0.0, -0.0, 0.0, -0.0, 0.0, -0.0, -0.00658524]]}, "free_energy": -11.004049127791916, "initial_magmoms": {"__ndarray__": [[4], "float64", [0.0, 0.0, 0.0, 0.0]]}, "magmom": 0.0, "magmoms": {"__ndarray__": [[4], "float64", [0.0, 0.0, 0.0, 0.0]]}, "mtime": 24.891818716252992, "numbers": {"__ndarray__": [[4], "int64", [17, 47, 47, 17]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, false]]}, "positions": {"__ndarray__": [[4, 3], "float64", [2.11465755, 2.11465755, 15.3229962, 3.37430115, 0.85501395, 16.906922, 0.85501395, 3.37430115, 16.906922, -0.0, 0.0, 18.4908478]]}, "stress": {"__ndarray__": [[6], "float64", [-1.604567663146047e-05, -1.6045676631460937e-05, 4.380831277549354e-05, -1.958957084556099e-22, -6.450546241324994e-23, -4.323191864374369e-05]]}, "unique_id": "7b6debd2b0a30653126efb9f53c095df", "user": "cmr"}, "ids": [1], "nextid": 2}