{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [9.278739275, -0.0, 0.0, -0.0, 9.281872848, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325507685195944,
 "energy": -50.35172755,
 "forces": {"__ndarray__": [[14, 3], "float64", [-0.002638, -0.003581, -0.0, 0.002638, 0.003581, -0.0, 0.002638, -0.003581, 0.0, -0.002638, 0.003581, 0.0, -0.000835, 0.000585, 0.0, 0.000835, -0.000585, -0.0, 0.000835, 0.000585, 0.0, -0.000835, -0.000585, -0.0, 0.006787, -0.003802, 0.0, -0.006787, 0.003802, 0.0, -0.006787, -0.003802, -0.0, 0.006787, 0.003802, -0.0, -0.0, -0.0, 0.0, -0.0, 0.0, 0.0]]},
 "free_energy": -50.40192053,
 "key_value_pairs": {"E": 0.2375858892857143, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857},
 "mtime": 25.051865240490766,
 "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", [1.73306, 6.37419, 10.0, 7.54568, 2.90768, 10.0, 2.90631, 1.73326, 10.0, 6.37243, 7.54861, 10.0, 2.76091, 4.13098, 10.0, 6.51783, 5.15089, 10.0, 1.87846, 8.77192, 10.0, 7.40028, 0.50996, 10.0, 5.14757, 2.76472, 10.0, 4.13117, 6.51715, 10.0, 8.77053, 7.40566, 10.0, 0.5082, 1.87621, 10.0, 4.63937, -0.0, 10.0, -0.0, 4.64094, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [2.028490465912059e-05, 2.5771191180771973e-05, 0.00047117152391292714, -0.0, -0.0, 0.0]]},
 "unique_id": "973503ff692ab057671700bf82a7be1b",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}