{"1": { "calculator": "gpaw", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [4.310744, 0.0, 0.0, -2.155372, 3.733214, 0.0, 0.0, 0.0, 5.071131]]}, "__ase_objtype__": "cell"}, "ctime": 24.896325732333615, "dipole": {"__ndarray__": [[3], "float64", [-3.080342992230305e-05, -0.00016868082030485474, 0.000329212250287783]]}, "energy": -10.448411375167364, "forces": {"__ndarray__": [[3, 3], "float64", [0.02578947628943356, 0.04421476420997377, 0.0014320302026185209, -0.05341587036383578, 0.001043812624080845, -0.0021752246944671573, 0.027615063136869955, -0.04526589216469913, 0.0007405129669839074]]}, "mtime": 24.896325732333615, "numbers": {"__ndarray__": [[3], "int64", [34, 34, 34]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]}, "positions": {"__ndarray__": [[3, 3], "float64", [1.6545000001444872, 2.865669999897367, 0.0, 1.0017499998355992, 0.0, 1.6905499999436882, -0.5008744274509964, 0.8675399999638318, 3.3809200000925315]]}, "stress": {"__ndarray__": [[6], "float64", [-0.002905037351046164, -0.00290179107418185, -0.003453187602061077, -9.733251429956494e-06, 5.5865797398942464e-05, 1.7405187662822053e-05]]}, "unique_id": "b46fbcfcaa2ef13529387034e8d31b47", "user": "cmr"}, "ids": [1], "nextid": 2}