{"1": { "calculator": "unknown", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [4.527866006771272, -1.5070186452863385e-18, 0.0, 2.816466615704867e-16, 4.527866006771272, 0.0, -6.873050234365389e-18, 0.0, 19.016366517139588]]}, "__ase_objtype__": "cell"}, "ctime": 24.891407944387826, "dipole": {"__ndarray__": [[3], "float64", [-7.58062300234784e-14, -3.3705977776350266e-14, -6.0984391108213674e-09]]}, "energy": -9.64773231698996, "free_energy": -9.647732317031911, "initial_magmoms": {"__ndarray__": [[4], "float64", [0.0, 0.0, 0.0, 0.0]]}, "mtime": 24.891407944387826, "numbers": {"__ndarray__": [[4], "int64", [53, 53, 47, 47]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, false]]}, "positions": {"__ndarray__": [[4, 3], "float64", [0.0, -0.0, 11.35767038, 2.263933, 2.263933, 7.6586968, 2.263933, 0.0, 9.50818357, 0.0, 2.263933, 9.50818357]]}, "unique_id": "3a67a786d1c71c2aabaf212215c3f4da", "user": "cmr"}, "ids": [1], "nextid": 2}