{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [13.51747986, -0.0, 0.0, 0.0, 5.329836176, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325505972412746,
 "energy": -43.97205318,
 "forces": {"__ndarray__": [[12, 3], "float64", [-0.003973, -0.008249, 0.0, -0.003973, 0.008249, 0.0, 0.003973, -0.008249, 0.0, 0.003973, 0.008249, 0.0, 0.000571, -0.00682, 0.0, 0.000571, 0.00682, -0.0, -0.000571, -0.00682, 0.0, -0.000571, 0.00682, 0.0, -0.0, -0.002313, -0.0, -0.0, 0.002313, -0.0, -0.0, 0.002237, 0.0, -0.0, -0.002237, 0.0]]},
 "free_energy": -44.02032372,
 "key_value_pairs": {"E": 0.2757909016666664, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.143548877145275,
 "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", [12.16519, 1.77112, 10.0, 5.40645, 3.55871, 10.0, 8.11103, 1.77112, 10.0, 1.35229, 3.55871, 10.0, 5.85668, 1.04144, 10.0, 12.61542, 4.2884, 10.0, 0.90206, 1.04144, 10.0, 7.6608, 4.2884, 10.0, 10.13811, 0.3917, 10.0, 3.37937, 4.93814, 10.0, 10.13811, 3.10135, 10.0, 3.37937, 2.22849, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-1.0623048532253306e-05, -2.2051251741745552e-05, 0.0005881124388954759, -0.0, -0.0, 0.0]]},
 "unique_id": "848406a5cfa2314c757f78f459984f8e",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}