{"1": { "calculator": "unknown", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [3.7390133436440967, -2.821286667357808e-21, 0.0, -1.8695066718220483, 3.238080540684783, 0.0, -1.601511513808066e-20, 0.0, 17.15261343971305]]}, "__ase_objtype__": "cell"}, "ctime": 24.891685217986126, "dipole": {"__ndarray__": [[3], "float64", [2.6307041331431034, -1.5188377394284376, 4.643804545969921e-14]]}, "energy": -11.352373126794362, "free_energy": -11.361837501650816, "initial_magmoms": {"__ndarray__": [[3], "float64", [1.0, 1.0, 1.0]]}, "magmom": 0.8363923233160353, "magmoms": {"__ndarray__": [[3], "float64", [0.23092925, 0.1910036, 0.1910036]]}, "mtime": 24.891685217986126, "numbers": {"__ndarray__": [[3], "int64", [29, 16, 16]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, false]]}, "positions": {"__ndarray__": [[3, 3], "float64", [0.0, 0.0, 8.57630672, 1.86950667, 1.07936018, 9.6504632, 1.86950667, 1.07936018, 7.50215024]]}, "unique_id": "8e1e28f9d62a5a3b9b0f1803de1fa05e", "user": "cmr"}, "ids": [1], "nextid": 2}