{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [8.886764282, 0.0, 0.0, -0.0, 8.095837842, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325506162101096,
 "energy": -43.72390946,
 "forces": {"__ndarray__": [[12, 3], "float64", [0.0, -0.000242, -0.0, -0.0, 0.000242, -0.0, -0.0, 0.001882, -0.0, 0.0, -0.001882, -0.0, 0.002017, -0.003974, -0.0, -0.002017, 0.003974, -0.0, 0.002017, 0.003974, -0.0, -0.002017, -0.003974, -0.0, -0.0, 0.006879, -0.0, 0.0, -0.006879, 0.0, -0.0, -0.0, 0.0, 0.0, -0.0, -0.0]]},
 "free_energy": -43.77963534,
 "key_value_pairs": {"E": 0.2964695449999999, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.143519578516525,
 "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", [2.22169, 5.14005, 10.00002, 6.66507, 2.95578, 10.00002, 2.22169, 0.15709, 10.00002, 6.66507, 7.93875, 10.00002, 4.08317, 6.7737, 10.00002, 4.8036, 1.32213, 10.00002, 8.52655, 1.32213, 10.00002, 0.36021, 6.7737, 10.00002, 6.66507, 5.59452, 10.00002, 2.22169, 2.50132, 10.00002, -0.0, 4.04792, 10.00002, 4.44338, 4.04792, 10.00002]]},
 "stress": {"__ndarray__": [[6], "float64", [-1.2052354122080573e-05, 7.2027015312692805e-06, 0.0005155236877614536, -0.0, -0.0, 0.0]]},
 "unique_id": "5f789a1b4bf6af86394dfc15edc6d230",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}