{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [7.650751354, -0.0, 0.0, -0.0, 9.321628447, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550691296595,
 "energy": -44.3518763,
 "forces": {"__ndarray__": [[12, 3], "float64", [0.00698, -8.3e-05, 0.0, -0.00698, 8.3e-05, -0.0, -0.00698, -8.3e-05, -0.0, 0.00698, 8.3e-05, 0.0, -0.010891, 0.019532, 0.0, 0.010891, -0.019532, -0.0, 0.010891, 0.019532, -0.0, -0.010891, -0.019532, 0.0, -0.019143, 0.000595, -0.0, 0.019143, -0.000595, 0.0, 0.019143, 0.000595, 0.0, -0.019143, -0.000595, -0.0]]},
 "free_energy": -44.39919649,
 "key_value_pairs": {"E": 0.24413897499999995, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.14535270274792,
 "numbers": {"__ndarray__": [[12], "int32", [14, 14, 14, 14, 79, 79, 79, 79, 79, 79, 79, 79]]},
 "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]},
 "positions": {"__ndarray__": [[12, 3], "float64", [2.84056, 7.71333, 10.0, 4.8102, 1.60829, 10.0, 0.98482, 3.05252, 10.0, 6.66593, 6.26911, 10.0, 5.21897, 8.49505, 10.0, 2.43178, 0.82658, 10.0, 6.25716, 3.83424, 10.0, 1.3936, 5.48739, 10.0, 0.50222, 8.09807, 10.0, 7.14853, 1.22356, 10.0, 3.32315, 3.43726, 10.0, 4.3276, 5.88437, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-1.5210557739777499e-05, 2.211990834213027e-05, 0.0006432998625865357, -0.0, -0.0, -0.0]]},
 "unique_id": "d52fc2bcc89d597517c649386ec5e00f",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}