{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [7.66130919, -0.0, 0.0, 0.0, 9.311939458, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550634379249,
 "energy": -44.35005533,
 "forces": {"__ndarray__": [[12, 3], "float64", [-0.000453, 0.009396, 0.0, 0.000453, -0.009396, 0.0, -0.000453, -0.009396, 0.0, 0.000453, 0.009396, 0.0, 0.010712, -0.015153, -0.0, -0.010712, 0.015153, -0.0, 0.010712, 0.015153, 0.0, -0.010712, -0.015153, -0.0, 0.003977, -0.011182, -0.0, -0.003977, 0.011182, -0.0, 0.003977, 0.011182, 0.0, -0.003977, -0.011182, 0.0]]},
 "free_energy": -44.39639531,
 "key_value_pairs": {"E": 0.24429072249999972, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.14366205913677,
 "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", [2.85785, 6.25608, 10.0, 4.80346, 3.05586, 10.0, 6.68851, 7.71183, 10.0, 0.9728, 1.60011, 10.0, 3.31875, 1.22235, 10.0, 4.34256, 8.08959, 10.0, 7.1494, 3.43362, 10.0, 0.51191, 5.87832, 10.0, 6.25212, 0.83095, 10.0, 1.40919, 8.48098, 10.0, 2.42146, 3.82501, 10.0, 5.23985, 5.48692, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-6.271468369687499e-05, -5.7783891487427206e-05, 0.0006299492745662714, -0.0, -0.0, -0.0]]},
 "unique_id": "1ef418f2da13a6f2860fe6db6ae0deef",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}