{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [11.490856465, -0.0, 0.0, 0.0, 7.468732619, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550600988978,
 "energy": -50.04010463,
 "forces": {"__ndarray__": [[14, 3], "float64", [0.007004, 0.006491, 0.0, -0.007004, 0.006491, -0.0, -0.007004, -0.006491, -0.0, 0.007004, -0.006491, -0.0, 0.0, -0.002554, 0.0, 0.0, 0.002554, 0.0, 0.00906, 0.002156, -0.0, -0.00906, 0.002156, -0.0, -0.00906, -0.002156, 0.0, 0.00906, -0.002156, 0.0, 0.009457, 1.7e-05, -0.0, -0.009457, 1.7e-05, -0.0, -0.009457, -1.7e-05, 0.0, 0.009457, -1.7e-05, 0.0]]},
 "free_energy": -50.10774791,
 "key_value_pairs": {"E": 0.25984466928571415, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857},
 "mtime": 25.644608577874564,
 "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", [10.99021, 1.86636, 10.0, 6.24607, 1.86636, 10.0, 0.50065, 5.60237, 10.0, 5.24478, 5.60237, 10.0, 8.61814, 1.86739, 10.0, 2.87271, 5.60134, 10.0, 7.20625, 6.98641, 10.0, 10.03004, 6.98641, 10.0, 4.28461, 0.48232, 10.0, 1.46082, 0.48232, 10.0, 1.46031, 3.25291, 10.0, 4.28512, 3.25291, 10.0, 10.03054, 4.21583, 10.0, 7.20574, 4.21583, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-7.359987561241538e-05, 6.738333252303565e-05, 0.0006562884430774987, -0.0, -0.0, -0.0]]},
 "unique_id": "3fd276a885e20c75934755745a460e9e",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}