{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [9.349500411, 0.0, 0.0, -0.0, 7.618996182, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325506803255294,
 "energy": -44.3383567,
 "forces": {"__ndarray__": [[12, 3], "float64", [0.006923, 0.000453, 0.0, -0.006923, -0.000453, 0.0, 0.006923, -0.000453, 0.0, -0.006923, 0.000453, 0.0, -0.005682, 0.006001, 0.0, 0.005682, -0.006001, -0.0, -0.005682, -0.006001, 0.0, 0.005682, 0.006001, 0.0, -0.006458, 0.006246, -0.0, 0.006458, -0.006246, -0.0, -0.006458, -0.006246, 0.0, 0.006458, 0.006246, 0.0]]},
 "free_energy": -44.38773524,
 "key_value_pairs": {"E": 0.24526560833333347, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.143608208426173,
 "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", [1.62011, 1.00763, 10.00002, 7.72939, 6.61137, 10.00002, 6.29486, 2.80187, 10.00002, 3.05464, 4.81712, 10.00002, 5.9075, 0.47365, 10.00002, 3.442, 7.14534, 10.00002, 1.23275, 3.33585, 10.00002, 8.11675, 4.28315, 10.00002, 3.86086, 2.44572, 10.00002, 5.48864, 5.17327, 10.00002, 8.53561, 1.36378, 10.00002, 0.81389, 6.25522, 10.00002]]},
 "stress": {"__ndarray__": [[6], "float64", [5.372691055560309e-05, -5.2584714385566446e-05, 0.0006502841112983991, -0.0, -0.0, -0.0]]},
 "unique_id": "6f33953d8fd6295c9158a1a9207bbbe8",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}