{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [10.467430984, -1e-08, 0.0, -5.233716011, 9.065061338, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550528386944,
 "energy": -59.67886295,
 "forces": {"__ndarray__": [[16, 3], "float64", [0.000366, -0.000635, -0.0, 0.000366, 0.000635, -0.0, -0.000733, 0.0, -0.0, 0.004069, -0.007048, 0.0, 0.004069, 0.007048, 0.0, -0.008138, 0.0, -0.0, -0.002205, 0.001236, 0.0, 3.2e-05, -0.002528, 0.0, 0.002173, 0.001292, 0.0, 0.002173, -0.001292, 0.0, -0.002205, -0.001236, 0.0, 3.2e-05, 0.002528, 0.0, -0.000804, -0.001392, 0.0, 0.001607, -0.0, 0.0, -0.000804, 0.001392, -0.0, 0.0, 0.0, 0.0]]},
 "free_energy": -59.74583895,
 "key_value_pairs": {"E": 0.302941690625, "Au_rate": 0.625, "Si_rate": 0.375},
 "mtime": 24.9823374482923,
 "numbers": {"__ndarray__": [[16], "int32", [14, 14, 14, 14, 14, 14, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79]]},
 "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]},
 "positions": {"__ndarray__": [[16, 3], "float64", [-2.51327, 4.35312, 10.0, 2.72044, 4.71194, 10.0, 5.02655, -0.0, 10.0, -3.98891, 6.909, 10.0, 1.24481, 2.15607, 10.0, 7.97782, -0.0, 10.0, 6.4126, 1.91257, 10.0, 5.6048, 4.59718, 10.0, 3.68376, 2.5553, 10.0, -1.54997, 6.50976, 10.0, 1.17887, 7.15249, 10.0, 0.37108, 4.46788, 10.0, 3.89289, 6.74268, 10.0, 2.68166, -0.0, 10.0, -1.34083, 2.32238, 10.0, -0.0, -0.0, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [1.3775010640824352e-05, 1.3775010640824352e-05, 0.0005320512039267924, 0.0, 0.0, -0.0]]},
 "unique_id": "2601c38e17ab4620032aeb8ce55ca2f1",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}