{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [7.661238714, 0.0, 0.0, 0.0, 9.316617581, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550679797489,
 "energy": -44.34897775,
 "forces": {"__ndarray__": [[12, 3], "float64", [0.003359, -0.00906, 0.0, -0.003359, 0.00906, -0.0, -0.003359, -0.00906, -0.0, 0.003359, 0.00906, 0.0, 0.006544, -0.001369, -0.0, -0.006544, 0.001369, -0.0, -0.006544, -0.001369, 0.0, 0.006544, 0.001369, 0.0, 0.004848, 0.002647, -0.0, -0.004848, -0.002647, -0.0, -0.004848, 0.002647, 0.0, 0.004848, -0.002647, 0.0]]},
 "free_energy": -44.39556451,
 "key_value_pairs": {"E": 0.2443805208333331, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.65195125409904,
 "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", [4.80702, 6.26603, 10.0, 2.85422, 3.05058, 10.0, 6.68484, 1.60773, 10.0, 0.9764, 7.70889, 10.0, 7.14989, 5.87984, 10.0, 0.51135, 3.43678, 10.0, 4.34197, 1.22153, 10.0, 3.31927, 8.09509, 10.0, 6.25911, 8.48979, 10.0, 1.40213, 0.82683, 10.0, 5.23275, 3.83148, 10.0, 2.42849, 5.48514, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-1.26390559799136e-05, 7.45610680178014e-05, 0.0006845250303629946, -0.0, -0.0, -0.0]]},
 "unique_id": "1a913478a5af46a565cb199bd1561e4f",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}