{"1": { "calculator": "unknown", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [3.938539979270489, 2.9750078742907106e-17, 0.0, -1.9692699896352424, 3.410875675868939, 0.0, 6.428656546155078e-17, 3.642439378972277e-35, 31.524559999999997]]}, "__ase_objtype__": "cell"}, "ctime": 24.926452171453878, "dipole": {"__ndarray__": [[3], "float64", [-1.0199405220569062, 0.5888629349669849, 4.4220505245795064e-14]]}, "energy": -6.922741727626433, "forces": {"__ndarray__": [[2, 3], "float64", [-0.0, 0.0, -0.00114301, 0.0, -0.0, 0.00114301]]}, "free_energy": -6.924654763876814, "initial_magmoms": {"__ndarray__": [[2], "float64", [0.0, 0.0]]}, "magmom": 0.0, "magmoms": {"__ndarray__": [[2], "float64", [0.0, 0.0]]}, "mtime": 24.926452171453878, "numbers": {"__ndarray__": [[2], "int64", [16, 16]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, false]]}, "positions": {"__ndarray__": [[2, 3], "float64", [0.0, -0.0, 16.03646124, 0.0, 2.27391712, 15.48809876]]}, "stress": {"__ndarray__": [[6], "float64", [-7.656056882832851e-07, -7.656056882820407e-07, 3.943739904156854e-05, -6.221678422403653e-19, 0.0, 0.0]]}, "unique_id": "efc356c08621ff1e0a3ac5ef49646f05", "user": "cmr"}, "ids": [1], "nextid": 2}