{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [11.498236771, 0.0, 0.0, 0.0, 7.462007928, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550587452498,
 "energy": -50.04235546,
 "forces": {"__ndarray__": [[14, 3], "float64", [-0.001647, 0.005639, 0.0, 0.001647, 0.005639, -0.0, 0.001647, 0.005639, -0.0, -0.001647, 0.005639, 0.0, -0.006088, -0.006362, -0.0, 0.006088, -0.006362, -0.0, 0.006088, -0.006362, 0.0, -0.006088, -0.006362, -0.0, -0.0, -0.003642, -0.0, -0.0, -0.003642, -0.0, 0.000772, 0.002544, 0.0, -0.000772, 0.002544, -0.0, -0.000772, 0.002544, 0.0, 0.000772, 0.002544, 0.0]]},
 "free_energy": -50.10984499,
 "key_value_pairs": {"E": 0.25968389571428546, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857},
 "mtime": 25.143526831168124,
 "numbers": {"__ndarray__": [[14], "int32", [14, 14, 14, 14, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79]]},
 "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]},
 "positions": {"__ndarray__": [[14, 3], "float64", [8.1237, 1.27558, 9.99998, 3.37454, 1.27558, 10.00002, 9.12366, 5.00658, 9.99998, 2.37458, 5.00658, 10.00002, 1.41321, 7.3534, 9.99998, 10.08503, 7.3534, 10.00002, 4.33591, 3.62239, 9.99998, 7.16232, 3.62239, 10.00002, 0.0, 5.00798, 10.0, 5.74912, 1.27697, 10.0, 10.08554, 2.66129, 9.99998, 1.41269, 2.66129, 10.00002, 7.16181, 6.3923, 9.99998, 4.33642, 6.3923, 10.00002]]},
 "stress": {"__ndarray__": [[6], "float64", [3.307375685805539e-05, -9.293607088440171e-06, 0.0005932055103421967, -0.0, -0.0, -0.0]]},
 "unique_id": "483b874647c6500103e5b4b5c319d1bd",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}