{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [8.089645737, 0.0, 0.0, 0.0, 8.890494516, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325505381385792,
 "energy": -43.74871218,
 "forces": {"__ndarray__": [[12, 3], "float64", [-0.004146, 0.008581, 0.0, 0.004146, 0.008581, -0.0, 0.004253, 0.002262, -0.0, -0.004253, 0.002262, -0.0, 0.007241, -0.004641, 0.0, -0.007241, -0.004641, 0.0, -0.005382, 0.001834, 0.0, 0.005382, 0.001834, -0.0, 0.002596, -0.003012, -0.0, -0.002596, -0.003012, -0.0, -0.007014, -0.005023, 0.0, 0.007014, -0.005023, 0.0]]},
 "free_energy": -43.79608728,
 "key_value_pairs": {"E": 0.29440265166666685, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 24.982312517095234,
 "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", [2.96256, 5.40171, 10.0, 5.12708, 0.95646, 10.0, 7.93671, 5.40393, 10.0, 0.15293, 0.95868, 10.0, 6.76316, 2.81834, 10.0, 1.32649, 7.26359, 10.0, 2.49573, 0.95867, 10.0, 5.59392, 5.40391, 10.0, 4.04628, 7.6275, 10.0, 4.04337, 3.18225, 10.0, 1.31894, 3.53887, 10.0, 6.77071, 7.98411, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [2.3948670516014062e-05, -1.2938648417955992e-05, 0.0005640326966878182, -0.0, -0.0, -0.0]]},
 "unique_id": "38a3b9198fa2c4af88864262810e70d5",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}