{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [7.648849343, 0.0, 0.0, 0.0, 9.325609264, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325505373778416,
 "energy": -44.35696956,
 "forces": {"__ndarray__": [[12, 3], "float64", [0.000755, 0.012507, 0.0, -0.000755, 0.012507, 0.0, 0.010322, -0.012025, 0.0, -0.010322, -0.012025, 0.0, -0.011803, 0.005724, 0.0, 0.011803, 0.005724, -0.0, -0.005957, 0.012462, -0.0, 0.005957, 0.012462, 0.0, -0.002906, -0.011455, 0.0, 0.002906, -0.011455, 0.0, 0.033077, -0.007214, 0.0, -0.033077, -0.007214, -0.0]]},
 "free_energy": -44.40467457,
 "key_value_pairs": {"E": 0.24371453666666643, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 24.982384144360054,
 "numbers": {"__ndarray__": [[12], "int32", [14, 14, 14, 14, 79, 79, 79, 79, 79, 79, 79, 79]]},
 "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]},
 "positions": {"__ndarray__": [[12, 3], "float64", [2.90567, 1.79553, 10.0, 4.74318, 6.45833, 10.0, 0.91802, 5.02779, 10.0, 6.73083, 0.36499, 10.0, 1.41837, -0.02516, 10.0, 6.23048, 4.63764, 10.0, 3.29238, 4.2289, 10.0, 4.35647, 8.8917, 10.0, 5.24155, 2.18686, 10.0, 2.4073, 6.84966, 10.0, 0.52565, 2.59291, 10.0, 7.1232, 7.25572, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [0.00010525680989889526, 2.8274036340251163e-06, 0.0005310650454849029, -0.0, -0.0, -0.0]]},
 "unique_id": "7b42113f13c23f3c3a0e63e581e331a4",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}