{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [7.663505552, -0.0, 0.0, 0.0, 9.314356083, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325506843545842,
 "energy": -44.34625226,
 "forces": {"__ndarray__": [[12, 3], "float64", [0.001586, 0.003202, -0.0, -0.001586, -0.003202, 0.0, -0.001586, 0.003202, 0.0, 0.001586, -0.003202, -0.0, 0.007781, 0.00352, 0.0, -0.007781, -0.00352, -0.0, -0.007781, 0.00352, -0.0, 0.007781, -0.00352, 0.0, -0.007656, 0.003112, 0.0, 0.007656, -0.003112, -0.0, 0.007656, 0.003112, -0.0, -0.007656, -0.003112, 0.0]]},
 "free_energy": -44.39259592,
 "key_value_pairs": {"E": 0.244607645, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.143691145464086,
 "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", [0.97285, 1.60226, 10.0, 6.69066, 7.7121, 10.0, 2.8589, 6.25944, 10.0, 4.8046, 3.05492, 10.0, 2.42284, 3.82707, 10.0, 5.24066, 5.48729, 10.0, 1.40891, 8.48425, 10.0, 6.2546, 0.83011, 10.0, 4.34475, 8.09252, 10.0, 3.31876, 1.22184, 10.0, 7.15051, 3.43534, 10.0, 0.513, 5.87902, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [8.36923958689686e-05, 5.5536948202109235e-05, 0.0006050831022087525, -0.0, -0.0, -0.0]]},
 "unique_id": "d4ee0e4b9abd67524db3b20b165834bb",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}