{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [7.520475862, 0.0, 0.0, 0.0, 9.444957391, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550730727646,
 "energy": -44.32286087,
 "forces": {"__ndarray__": [[12, 3], "float64", [-0.009744, 0.00161, 0.0, 0.009744, -0.00161, -0.0, -0.009744, -0.00161, 0.0, 0.009744, 0.00161, -0.0, -0.00882, -0.002265, -0.0, 0.00882, 0.002265, 0.0, -0.00882, 0.002265, -0.0, 0.00882, -0.002265, 0.0, -0.00416, 0.000743, -0.0, 0.00416, -0.000743, 0.0, -0.00416, -0.000743, 0.0, 0.00416, 0.000743, 0.0]]},
 "free_energy": -44.37673253,
 "key_value_pairs": {"E": 0.24655692750000005, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.049894479593025,
 "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", [4.82857, 7.80748, 10.0, 2.69191, 1.63748, 10.0, 1.06833, 6.35996, 10.0, 6.45215, 3.085, 10.0, 3.37601, 5.97912, 10.0, 4.14447, 3.46584, 10.0, 7.13625, 8.18832, 10.0, 0.38423, 1.25664, 10.0, 2.47648, 8.64719, 10.0, 5.04399, 0.79777, 10.0, 6.23672, 5.52025, 10.0, 1.28376, 3.9247, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [3.6762488751452395e-06, 5.3177657752525354e-06, 0.0005672907644515293, -0.0, -0.0, 0.0]]},
 "unique_id": "2d95c0c0ff9e3a7bf85bbd9846682c41",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}