{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [10.662003452, 0.0, 0.0, -0.0, 13.513408125, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325506097425734,
 "energy": -87.96229824,
 "forces": {"__ndarray__": [[24, 3], "float64", [0.004936, 0.000635, 0.0, -0.004936, 0.000635, 0.0, 0.004936, -0.000635, -0.0, -0.004936, -0.000635, 0.0, -0.004936, -0.000635, 0.0, 0.004936, -0.000635, 0.0, -0.004936, 0.000635, 0.0, 0.004936, 0.000635, 0.0, 0.007205, -0.0, -0.0, -0.007205, -0.0, 0.0, 0.007205, -0.0, 0.0, -0.007205, -0.0, -0.0, 0.002526, 0.004544, -0.0, -0.002526, 0.004544, 0.0, 0.002526, -0.004544, -0.0, -0.002526, -0.004544, -0.0, -0.002526, -0.004544, 0.0, 0.002526, -0.004544, -0.0, -0.002526, 0.004544, 0.0, 0.002526, 0.004544, -0.0, 0.000771, -0.0, 0.0, -0.000771, -0.0, -0.0, 0.000771, -0.0, 0.0, -0.000771, -0.0, 0.0]]},
 "free_energy": -88.0653469,
 "key_value_pairs": {"E": 0.27503290666666685, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.1435838311551,
 "numbers": {"__ndarray__": [[24], "int32", [14, 14, 14, 14, 14, 14, 14, 14, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79]]},
 "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]},
 "positions": {"__ndarray__": [[24, 3], "float64", [7.10039, 8.10848, 10.0, 3.56162, 1.35178, 10.0, 1.76938, 12.16163, 10.0, 8.89262, 5.40493, 10.0, 3.56162, 5.40493, 10.0, 7.10039, 12.16163, 10.0, 8.89262, 1.35178, 10.0, 1.76938, 8.10848, 10.0, 0.38955, 10.13506, 10.0, 10.27245, 3.37835, 10.0, 5.72055, 10.13506, 10.0, 4.94145, 3.37835, 10.0, 1.04099, 5.85361, 10.0, 9.62101, 12.61032, 10.0, 6.37199, 0.90309, 10.0, 4.29001, 7.65979, 10.0, 9.62101, 7.65979, 10.0, 1.04099, 0.90309, 10.0, 4.29001, 12.61032, 10.0, 6.37199, 5.85361, 10.0, 7.56236, 3.37835, 10.0, 3.09964, 10.13506, 10.0, 2.23136, 3.37835, 10.0, 8.43064, 10.13506, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [5.393288035675724e-05, 1.9835516002056996e-05, 0.0005614487119097026, -0.0, -0.0, -0.0]]},
 "unique_id": "c3ea3e831903bfa7f4fb4add92f15e18",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}