{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [11.501181605, 0.0, 0.0, 0.0, 7.461797711, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550792404667,
 "energy": -50.03961386,
 "forces": {"__ndarray__": [[14, 3], "float64", [0.000908, -0.00412, 0.0, -0.000908, -0.00412, -0.0, -0.000908, -0.00412, -0.0, 0.000908, -0.00412, -0.0, 0.008266, -0.007287, 0.0, -0.008266, -0.007287, 0.0, -0.008266, -0.007287, -0.0, 0.008266, -0.007287, 0.0, -0.00162, 0.005337, -0.0, 0.00162, 0.005337, -0.0, 0.00162, 0.005337, -0.0, -0.00162, 0.005337, -0.0, 0.0, 0.01214, -0.0, 0.0, 0.01214, 0.0]]},
 "free_energy": -50.10701533,
 "key_value_pairs": {"E": 0.2598797242857141, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857},
 "mtime": 24.982302661102892,
 "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", [3.37596, 7.14048, 10.0, 8.12522, 7.14048, 10.0, 2.37463, 3.40958, 10.0, 9.12655, 3.40958, 10.0, 1.41218, 5.75567, 10.0, 10.089, 5.75567, 10.0, 4.33841, 2.02477, 10.0, 7.16277, 2.02477, 10.0, 7.16419, 4.79219, 10.0, 4.33699, 4.79219, 10.0, 10.08759, 1.06129, 10.0, 1.4136, 1.06129, 10.0, 0.0, 3.40638, 10.0, 5.75059, 7.13728, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [1.831258777534148e-05, 4.855894099937175e-06, 0.0006260857804173496, -0.0, -0.0, -0.0]]},
 "unique_id": "53fbed7d184a5f1d293ba3c00b95fc77",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}