{"1": { "calculator": "unknown", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [5.345521348887081, 0.06050948750702079, 0.0, -0.40355888904354903, 6.637920111506895, 0.0, -4.593356313574927e-16, -1.0697051311220367e-18, 33.86447668799999]]}, "__ase_objtype__": "cell"}, "ctime": 24.95934556694176, "dipole": {"__ndarray__": [[3], "float64", [18.852665708477044, -7.635727255687621, -1.330851701145821e-12]]}, "energy": -46.59963231169468, "forces": {"__ndarray__": [[10, 3], "float64", [0.00188711, 0.00305998, 0.00389539, 0.00188711, 0.00305998, -0.00389539, 0.00047685, -0.00240952, -0.00328058, 0.00047685, -0.00240952, 0.00328058, -0.00498047, -0.0009173, 0.00104501, -0.00498047, -0.0009173, -0.00104501, 0.00051565, 0.00022103, -0.00220042, 0.00051565, 0.00022103, 0.00220042, 0.00201559, 0.00014087, 0.00209352, 0.00201559, 0.00014087, -0.00209352]]}, "free_energy": -46.59963231407564, "initial_magmoms": {"__ndarray__": [[10], "float64", [0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]]}, "magmom": 0.0, "magmoms": {"__ndarray__": [[10], "float64", [0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]]}, "mtime": 24.95934556694176, "numbers": {"__ndarray__": [[10], "int64", [15, 15, 15, 15, 16, 16, 16, 16, 16, 16]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, false]]}, "positions": {"__ndarray__": [[10, 3], "float64", [-8.274e-05, 0.20214089, 19.12299496, 2.47089849, 3.55135569, 14.74148173, -0.22252856, 5.81656829, 15.56313113, 2.65201156, 2.52786298, 18.30134555, 4.73409314, 5.3644925, 17.64224331, 2.26311191, 2.0152777, 16.22223338, 4.57151374, 4.02228282, 14.5778517, 2.10053251, 0.67306802, 19.28662498, 4.78668698, 2.26142064, 18.55272318, 1.91214686, 5.55012595, 15.3117535]]}, "stress": {"__ndarray__": [[6], "float64", [1.0817863438543835e-05, -8.715310281235328e-06, 6.283584160235741e-06, -7.744510133687708e-23, 1.4655310538350389e-22, -5.689336594945738e-06]]}, "unique_id": "9f0a85655cad0d129f1ac95aeeb313c4", "user": "cmr"}, "ids": [1], "nextid": 2}