{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [11.498754244, 0.0, 0.0, 0.0, 7.464497537, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550789786386,
 "energy": -50.03873027,
 "forces": {"__ndarray__": [[14, 3], "float64", [0.000525, -0.002271, -0.0, -0.000525, -0.002271, -0.0, 0.000525, -0.002271, 0.0, -0.000525, -0.002271, 0.0, 0.003222, -0.003473, 0.0, -0.003222, -0.003473, 0.0, 0.003222, -0.003473, -0.0, -0.003222, -0.003473, 0.0, -0.0, 0.009006, -0.0, 0.0, 0.009006, 0.0, -0.000228, 0.001241, 0.0, 0.000228, 0.001241, -0.0, -0.000228, 0.001241, 0.0, 0.000228, 0.001241, -0.0]]},
 "free_energy": -50.10621377,
 "key_value_pairs": {"E": 0.25994283785714273, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857},
 "mtime": 25.423641563679045,
 "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", [3.3759, 2.38248, 9.99998, 2.37348, 6.11473, 10.00002, 9.12528, 6.11473, 10.00002, 8.12285, 2.38248, 9.99998, 1.41263, 0.99865, 9.99998, 4.33674, 4.7309, 10.00002, 7.16201, 4.7309, 10.00002, 10.08612, 0.99865, 9.99998, 5.74938, 2.3821, 9.99998, 0.0, 6.11435, 10.00002, 4.33651, 0.03494, 9.99998, 1.41287, 3.76719, 10.00002, 10.08589, 3.76719, 10.00002, 7.16224, 0.03494, 9.99998]]},
 "stress": {"__ndarray__": [[6], "float64", [-2.059698011541475e-06, 5.315269171602183e-05, 0.0005291176946376274, -0.0, -0.0, -0.0]]},
 "unique_id": "e279539bbc35b9bc11bc411d0e72e2f2",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}