{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [9.343851697, 0.0, 0.0, 0.0, 7.623233585, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325505488728844,
 "energy": -44.34419326,
 "forces": {"__ndarray__": [[12, 3], "float64", [0.000668, -0.000348, -0.0, -0.000668, -0.000348, -0.0, 0.005485, 0.00773, 0.0, -0.005485, 0.00773, 0.0, -0.002304, -0.004129, 0.0, 0.002304, -0.004129, 0.0, 0.003703, 0.000644, -0.0, -0.003703, 0.000644, -0.0, -0.00734, -0.004801, 0.0, 0.00734, -0.004801, 0.0, -0.003583, 0.000904, 0.0, 0.003583, 0.000904, 0.0]]},
 "free_energy": -44.39333866,
 "key_value_pairs": {"E": 0.24477922833333357, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.413217006805276,
 "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", [3.95767, 1.30956, 10.0, 5.38619, 5.12118, 10.0, 8.62726, 7.13915, 10.0, 0.71659, 3.32754, 10.0, 3.56605, 6.60545, 10.0, 5.7778, 2.79382, 10.0, 1.52222, 0.95646, 10.0, 7.82164, 4.76808, 10.0, 6.19382, 7.49151, 10.0, 3.15003, 3.67989, 10.0, 8.23969, 1.84362, 10.0, 1.10417, 5.65524, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [2.597716098192612e-05, 2.0821674443946552e-05, 0.0006186146939936674, -0.0, -0.0, -0.0]]},
 "unique_id": "2f00f7b3cd54e0736ed44aa404f0db13",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}