{"1": { "calculator": "unknown", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [6.814972985344993, 3.765677596014752e-18, 0.0, -3.4074864926724975, 5.901939731413441, 0.0, -1.067446424749847e-18, 0.0, 18.222923957596116]]}, "__ase_objtype__": "cell"}, "ctime": 24.797842790374336, "dipole": {"__ndarray__": [[3], "float64", [8.030917937210864e-06, -4.636657606415349e-06, -6.024474024485408e-08]]}, "energy": -16.741540499968394, "free_energy": -16.773880383186018, "initial_magmoms": {"__ndarray__": [[8], "float64", [1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0]]}, "magmom": 1.4453428777779251, "magmoms": {"__ndarray__": [[8], "float64", [0.15550322, 0.15550421, 0.08949938, 0.08949938, 0.08949938, 0.08949939, 0.08949939, 0.08949939]]}, "mtime": 24.797842790374336, "numbers": {"__ndarray__": [[8], "int64", [47, 47, 17, 17, 17, 17, 17, 17]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, false]]}, "positions": {"__ndarray__": [[8, 3], "float64", [3.40748649, 1.96731324, 9.11248153, 0.0, 3.93462649, 9.11044231, 3.41036277, -0.00068448, 7.50454557, 1.70171233, 2.94882118, 7.50454557, -1.70458861, 2.95380303, 7.50454557, 3.41036261, 0.00068455, 10.71837847, 1.70289802, 2.9481368, 10.71837847, -1.70577414, 2.95311838, 10.71837847]]}, "unique_id": "1dcbac85bc2111705d4b45808c97d15a", "user": "cmr"}, "ids": [1], "nextid": 2}