{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [10.666769906, -0.0, 0.0, -0.0, 13.516331379, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325507991966507,
 "energy": -87.94977238,
 "forces": {"__ndarray__": [[24, 3], "float64", [0.003756, -0.003937, 0.0, 0.003756, 0.003937, -0.0, -0.003756, 0.003937, -0.0, -0.003756, -0.003937, -0.0, -0.003756, 0.003937, 0.0, -0.003756, -0.003937, -0.0, 0.003756, -0.003937, 0.0, 0.003756, 0.003937, 0.0, -0.002225, 0.0, -0.0, 0.002225, -0.0, -0.0, 0.002225, -0.0, -0.0, -0.002225, 0.0, 0.0, 0.018518, -0.031162, -0.0, 0.018518, 0.031162, -0.0, -0.018518, 0.031162, 0.0, -0.018518, -0.031162, 0.0, -0.018518, 0.031162, 0.0, -0.018518, -0.031162, 0.0, 0.018518, -0.031162, -0.0, 0.018518, 0.031162, 0.0, -0.009477, 0.0, 0.0, 0.009477, -0.0, -0.0, 0.009477, -0.0, -0.0, -0.009477, 0.0, -0.0]]},
 "free_energy": -88.05293398,
 "key_value_pairs": {"E": 0.27555481750000005, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 24.983953798334184,
 "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", [4.43562, 5.40657, 10.0, 4.43562, 1.3516, 10.0, 0.89777, 8.10977, 10.0, 0.89777, 12.16473, 10.0, 6.23115, 8.10977, 10.0, 6.23115, 12.16473, 10.0, 9.769, 5.40657, 10.0, 9.769, 1.3516, 10.0, 8.38902, 3.37908, 10.0, 7.61113, 10.13725, 10.0, 2.27775, 10.13725, 10.0, 3.05564, 3.37908, 10.0, 1.62321, 0.90492, 10.0, 1.62321, 5.85324, 10.0, 3.71017, 12.61141, 10.0, 3.71017, 7.66309, 10.0, 9.04356, 12.61141, 10.0, 9.04356, 7.66309, 10.0, 6.9566, 0.90492, 10.0, 6.9566, 5.85324, 10.0, 10.2344, 10.13725, 10.0, 5.76576, 3.37908, 10.0, 0.43237, 3.37908, 10.0, 4.90101, 10.13725, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [0.00019102138679765712, 0.0001292616539970423, 0.0005133266765491427, -0.0, -0.0, -0.0]]},
 "unique_id": "ce00ffebc9c2ecbdda12a2e133e31a7f",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}