{"1": { "calculator": "unknown", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [3.513138786886503, -3.4172244084274832e-18, 0.0, -1.7565693934431663, 6.124425111064922, 0.0, 1.453860130859618e-16, -3.788532031644944e-31, 34.18228619753993]]}, "__ase_objtype__": "cell"}, "ctime": 24.845905969045287, "dipole": {"__ndarray__": [[3], "float64", [1.5580893816133115, 3.1822963356454084, 0.1368228109548747]]}, "energy": -18.324758295525502, "forces": {"__ndarray__": [[5, 3], "float64", [-0.0, -0.00573032, -0.00267412, 0.0, 0.00208819, -0.00458388, 0.0, 0.00317069, 0.00091235, 0.0, 0.00016993, 0.00471815, 0.0, 0.00031489, 0.00160297]]}, "free_energy": -18.33737926910461, "initial_magmoms": {"__ndarray__": [[5], "float64", [0.0, 0.0, 0.0, 0.0, 0.0]]}, "magmom": 0.0, "magmoms": {"__ndarray__": [[5], "float64", [0.0, 0.0, 0.0, 0.0, 0.0]]}, "mtime": 24.845905969045287, "numbers": {"__ndarray__": [[5], "int64", [34, 34, 34, 13, 34]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, false]]}, "positions": {"__ndarray__": [[5, 3], "float64", [1.75656939, 3.80762848, 18.86809957, 1.75656939, 3.87275395, 14.74238638, 0.0, 5.44851159, 18.11766268, 1.75656939, 2.5871388, 16.68514724, 1.75656939, 7.0431632, 16.5414196]]}, "stress": {"__ndarray__": [[6], "float64", [1.5068019946889181e-05, -6.012441049052997e-06, 5.478870880872657e-07, 1.6355871897633548e-05, -7.594822292973209e-23, -2.1066138335134439e-19]]}, "unique_id": "596939e50bfdfc2385519dbada15fe86", "user": "cmr"}, "ids": [1], "nextid": 2}