{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [9.277381172, -0.0, 0.0, -0.0, 9.283758003, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550769536972,
 "energy": -50.34440482,
 "forces": {"__ndarray__": [[14, 3], "float64", [-0.008696, 0.004475, 0.0, 0.008696, -0.004475, 0.0, 0.008696, 0.004475, 0.0, -0.008696, -0.004475, 0.0, -0.00392, -0.002139, 0.0, 0.00392, 0.002139, -0.0, 0.00392, -0.002139, -0.0, -0.00392, 0.002139, -0.0, 6.5e-05, -0.002851, -0.0, -6.5e-05, 0.002851, 0.0, -6.5e-05, -0.002851, -0.0, 6.5e-05, 0.002851, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0]]},
 "free_energy": -50.39465434,
 "key_value_pairs": {"E": 0.23810894142857134, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857},
 "mtime": 25.14366801097725,
 "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", [6.37128, 6.37348, 10.0, 2.90611, 2.91027, 10.0, 7.5448, 1.7316, 10.0, 1.73259, 7.55215, 10.0, 1.87855, 5.15403, 10.0, 7.39883, 4.12973, 10.0, 2.76014, 0.51215, 10.0, 6.51724, 8.7716, 10.0, 0.50882, 2.76554, 10.0, 8.76856, 6.51822, 10.0, 4.12987, 7.40742, 10.0, 5.14751, 1.87634, 10.0, 0.0, 0.0, 10.0, 4.63869, 4.64188, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-1.0236074966448543e-06, 7.583433587948158e-06, 0.00045492487565825304, -0.0, -0.0, 0.0]]},
 "unique_id": "770a1ab7960ef9a0ff43696dda8e921b",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}