{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [9.278328752, 0.0, 0.0, 0.0, 9.278328752, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325505214573663,
 "energy": -50.37897244,
 "forces": {"__ndarray__": [[14, 3], "float64", [0.002645, 0.002645, -0.0, -0.002645, -0.002645, -0.0, 0.002645, -0.002645, -0.0, -0.002645, 0.002645, 0.0, 0.0, -0.0, -0.0, 0.0, -0.0, -0.0, -0.002357, 0.003428, -0.0, 0.002357, -0.003428, 0.0, 0.003428, 0.002357, -0.0, -0.003428, -0.002357, 0.0, -0.002357, -0.003428, 0.0, 0.002357, 0.003428, 0.0, 0.003428, -0.002357, -0.0, -0.003428, 0.002357, 0.0]]},
 "free_energy": -50.42931626,
 "key_value_pairs": {"E": 0.23563982571428582, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857},
 "mtime": 24.982327801911204,
 "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", [7.54666, 2.90749, 10.0, 1.73167, 6.37084, 10.0, 2.90749, 1.73167, 10.0, 6.37084, 7.54666, 10.0, 4.63916, -0.0, 10.0, 0.0, 4.63916, 10.0, 5.14967, 2.76173, 10.0, 4.12866, 6.5166, 10.0, 2.76173, 4.12866, 10.0, 6.5166, 5.14967, 10.0, 0.5105, 1.87744, 10.0, 8.76783, 7.40089, 10.0, 7.40089, 0.5105, 10.0, 1.87744, 8.76783, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [8.987773141271892e-06, 8.987773141271892e-06, 0.0005108737634626706, 0.0, 0.0, -0.0]]},
 "unique_id": "7a9f9ed15e2156cc8958469e5c81439e",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}