{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [10.662548537, -0.0, 0.0, -0.0, 13.515502889, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325507996887982,
 "energy": -87.94843872,
 "forces": {"__ndarray__": [[24, 3], "float64", [-0.002386, -0.006274, -0.0, 0.002386, -0.006274, -0.0, -0.002386, 0.006274, -0.0, 0.002386, 0.006274, -0.0, 0.002386, 0.006274, -0.0, -0.002386, 0.006274, -0.0, 0.002386, -0.006274, -0.0, -0.002386, -0.006274, -0.0, 0.003283, -0.0, 0.0, -0.003283, 0.0, 0.0, 0.003283, -0.0, 0.0, -0.003283, 0.0, -0.0, 0.003191, -0.003784, -0.0, -0.003191, -0.003784, 0.0, 0.003191, 0.003784, 0.0, -0.003191, 0.003784, -0.0, -0.003191, 0.003784, -0.0, 0.003191, 0.003784, 0.0, -0.003191, -0.003784, 0.0, 0.003191, -0.003784, -0.0, -0.001665, -0.0, -0.0, 0.001665, -0.0, 0.0, -0.001665, -0.0, 0.0, 0.001665, -0.0, -0.0]]},
 "free_energy": -88.05152028,
 "key_value_pairs": {"E": 0.27561038666666676, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.032112094436684,
 "numbers": {"__ndarray__": [[24], "int32", [14, 14, 14, 14, 14, 14, 14, 14, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79]]},
 "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]},
 "positions": {"__ndarray__": [[24, 3], "float64", [6.2265, 5.40606, 10.0, 4.43605, 12.16381, 10.0, 0.89522, 1.35169, 10.0, 9.76732, 8.10944, 10.0, 4.43605, 8.10944, 10.0, 6.2265, 1.35169, 10.0, 9.76732, 12.16381, 10.0, 0.89522, 5.40606, 10.0, 10.22704, 3.37888, 10.0, 0.4355, 10.13663, 10.0, 4.89577, 3.37888, 10.0, 5.76678, 10.13663, 10.0, 1.62418, 7.6607, 10.0, 9.03837, 0.90295, 10.0, 6.95545, 12.61255, 10.0, 3.7071, 5.8548, 10.0, 9.03837, 5.8548, 10.0, 1.62418, 12.61255, 10.0, 3.7071, 0.90295, 10.0, 6.95545, 7.6607, 10.0, 2.2748, 3.37888, 10.0, 8.38775, 10.13663, 10.0, 7.60607, 3.37888, 10.0, 3.05648, 10.13663, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [3.7293017027152464e-05, 6.425633645096814e-05, 0.0005461445315330369, -0.0, -0.0, -0.0]]},
 "unique_id": "b302882a03ff5d9a1c36d799d7811cb2",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}