{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [11.503181259, 0.0, 0.0, 0.0, 7.459959877, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325505862947125,
 "energy": -50.03403304,
 "forces": {"__ndarray__": [[14, 3], "float64", [0.002151, -0.006778, 0.0, -0.002151, -0.006778, 0.0, -0.002151, -0.006778, -0.0, 0.002151, -0.006778, -0.0, 0.000517, 0.008111, 0.0, -0.000517, 0.008111, 0.0, -0.000517, 0.008111, -0.0, 0.000517, 0.008111, -0.0, 0.0, -0.008688, -0.0, 0.0, -0.008688, 0.0, 0.006545, 0.003011, 0.0, -0.006545, 0.003011, 0.0, -0.006545, 0.003011, 0.0, 0.006545, 0.003011, 0.0]]},
 "free_energy": -50.1013876,
 "key_value_pairs": {"E": 0.2602783542857145, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857},
 "mtime": 25.143590084727705,
 "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", [9.12842, 7.38828, 10.0, 2.37476, 7.38828, 10.0, 8.12635, 3.6583, 10.0, 3.37682, 3.6583, 10.0, 1.41309, 5.04091, 10.0, 10.09009, 5.04091, 10.0, 4.3385, 1.31093, 10.0, 7.16468, 1.31093, 10.0, 5.75159, 3.65796, 10.0, -0.0, -0.07202, 10.0, 7.16405, 6.00381, 10.0, 4.33913, 6.00381, 10.0, 10.09072, 2.27383, 10.0, 1.41246, 2.27383, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-2.2219772488144397e-06, -5.450085768721261e-05, 0.0006086969359926388, -0.0, -0.0, -0.0]]},
 "unique_id": "b80471b8a92d974746c011ed5f4f050c",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}