{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [9.278583331, -0.0, 0.0, 0.0, 9.278151783, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325507786854388,
 "energy": -50.37505792,
 "forces": {"__ndarray__": [[14, 3], "float64", [-0.00564, 0.001546, 0.0, 0.00564, -0.001546, 0.0, -0.00564, -0.001546, 0.0, 0.00564, 0.001546, -0.0, -0.000739, 0.007881, -0.0, 0.000739, -0.007881, 0.0, -0.000739, -0.007881, 0.0, 0.000739, 0.007881, -0.0, 0.005392, -0.000515, 0.0, -0.005392, 0.000515, -0.0, 0.005392, 0.000515, -0.0, -0.005392, -0.000515, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]]},
 "free_energy": -50.42534739,
 "key_value_pairs": {"E": 0.23591943428571405, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857},
 "mtime": 25.422130572267378,
 "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", [1.73272, 6.37037, 10.0, 7.54586, 2.90778, 10.0, 6.37201, 7.54686, 10.0, 2.90657, 1.73129, 10.0, 8.76922, 7.40037, 10.0, 0.50936, 1.87779, 10.0, 4.12993, 6.51686, 10.0, 5.14865, 2.76129, 10.0, 7.40145, 0.51027, 10.0, 1.87713, 8.76788, 10.0, 2.76216, 4.1288, 10.0, 6.51642, 5.14935, 10.0, 4.63929, -0.0, 10.0, 0.0, 4.63908, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [6.129786112529949e-05, -1.310092765522896e-05, 0.0004887476136114144, -0.0, -0.0, -0.0]]},
 "unique_id": "778d7e1de6fb479ec4d22c05d32f2686",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}