{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [10.667319648, 0.0, 0.0, 0.0, 13.511356796, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325505813362852,
 "energy": -87.95008709,
 "forces": {"__ndarray__": [[24, 3], "float64", [-0.001907, -0.003783, 0.0, 0.001907, -0.003783, -0.0, -0.001907, -0.003783, 0.0, 0.001907, -0.003783, -0.0, 0.001062, 0.00695, 0.0, -0.001062, 0.00695, 0.0, 0.001062, 0.00695, 0.0, -0.001062, 0.00695, 0.0, -0.004735, -0.00164, 0.0, 0.004735, -0.00164, 0.0, -0.004735, -0.00164, 0.0, 0.004735, -0.00164, 0.0, 0.002072, 0.001344, -0.0, -0.002072, 0.001344, 0.0, 0.002072, 0.001344, -0.0, -0.002072, 0.001344, 0.0, 0.001077, 0.00021, -0.0, -0.001077, 0.00021, -0.0, 0.001077, 0.00021, 0.0, -0.001077, 0.00021, -0.0, -0.006365, -0.003082, 0.0, 0.006365, -0.003082, 0.0, -0.006365, -0.003082, 0.0, 0.006365, -0.003082, 0.0]]},
 "free_energy": -88.05277748,
 "key_value_pairs": {"E": 0.2755417045833335, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.052041138163528,
 "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", [9.77642, 0.94145, 9.99998, 0.8909, 7.69713, 10.00002, 4.44276, 0.94145, 10.00002, 6.22456, 7.69713, 9.99998, 9.77257, 4.99359, 9.99998, 0.89474, 11.74927, 10.00002, 4.43893, 4.99359, 10.00002, 6.2284, 11.74927, 9.99998, 6.96665, 5.44675, 9.99998, 3.70067, 12.20243, 10.00002, 1.63299, 5.44675, 10.00002, 9.03433, 12.20243, 9.99998, 6.95343, 0.49476, 9.99998, 3.71389, 7.25044, 10.00002, 1.61977, 0.49476, 10.00002, 9.04755, 7.25044, 9.99998, 2.27168, 9.71992, 9.99998, 8.39564, 2.96424, 10.00002, 7.60534, 9.71992, 10.00002, 3.06198, 2.96424, 9.99998, 10.22776, 9.73042, 9.99998, 0.43956, 2.97474, 10.00002, 4.8941, 9.73042, 10.00002, 5.77322, 2.97474, 9.99998]]},
 "stress": {"__ndarray__": [[6], "float64", [5.95377555518004e-05, -1.398722195110438e-05, 0.0005362205320228825, -0.0, -0.0, -0.0]]},
 "unique_id": "eed7577a35cff76a8f41c95583e5c1b1",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}