{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [11.500260009, 0.0, 0.0, 0.0, 7.463045705, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550586091372,
 "energy": -50.03877177,
 "forces": {"__ndarray__": [[14, 3], "float64", [-0.003821, -0.002014, 0.0, 0.003821, -0.002014, 0.0, -0.003821, -0.002014, -0.0, 0.003821, -0.002014, 0.0, 0.003443, 0.002775, 0.0, -0.003443, 0.002775, -0.0, 0.003443, 0.002775, -0.0, -0.003443, 0.002775, -0.0, 0.004406, 0.000521, -0.0, -0.004406, 0.000521, 0.0, 0.004406, 0.000521, 0.0, -0.004406, 0.000521, -0.0, 0.0, -0.002562, 0.0, 0.0, -0.002562, 0.0]]},
 "free_energy": -50.10626552,
 "key_value_pairs": {"E": 0.2599398735714288, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857},
 "mtime": 25.145270591864115,
 "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", [8.12323, 2.56712, 10.0, 9.12716, 6.29864, 10.0, 2.3731, 6.29864, 10.0, 3.37703, 2.56712, 10.0, 4.33688, 0.22044, 10.0, 1.41325, 3.95197, 10.0, 10.08701, 3.95197, 10.0, 7.16338, 0.22044, 10.0, 4.33733, 4.91431, 10.0, 1.4128, 1.18279, 10.0, 10.08746, 1.18279, 10.0, 7.16293, 4.91431, 10.0, 0.0, 6.29929, 10.0, 5.75013, 2.56777, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-4.818445045181876e-05, 1.9766859401672277e-05, 0.0004823812743030135, -0.0, -0.0, -0.0]]},
 "unique_id": "d5de122aa5854af4b0f54059496e3460",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}