{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [9.277691931, -1e-09, 0.0, 1e-09, 9.277691931, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550809333381,
 "energy": -50.3688996,
 "forces": {"__ndarray__": [[14, 3], "float64", [0.001622, 0.008697, -0.0, -0.001622, -0.008697, -0.0, 0.008697, -0.001622, -0.0, -0.008697, 0.001622, 0.0, 0.002056, -0.006413, -0.0, -0.002056, 0.006413, -0.0, -0.006413, -0.002056, -0.0, 0.006413, 0.002056, 0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.000888, -0.008854, 0.0, 0.000888, 0.008854, -0.0, -0.008854, 0.000888, 0.0, 0.008854, -0.000888, 0.0]]},
 "free_energy": -50.41915063,
 "key_value_pairs": {"E": 0.23635931428571436, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857},
 "mtime": 24.98239316027747,
 "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", [6.37039, 7.54532, 10.0, 2.9073, 1.73237, 10.0, 7.54532, 2.9073, 10.0, 1.73237, 6.37039, 10.0, 5.14864, 2.76264, 10.0, 4.12905, 6.51505, 10.0, 2.76264, 4.12905, 10.0, 6.51505, 5.14864, 10.0, 0.0, 4.63885, 10.0, 4.63885, -0.0, 10.0, 0.50978, 1.87795, 10.0, 8.76791, 7.39975, 10.0, 1.87795, 8.76791, 10.0, 7.39975, 0.50978, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-1.7207840660060146e-05, -1.7207840660060146e-05, 0.00046240844510018705, -0.0, -0.0, 0.0]]},
 "unique_id": "6e91557b5556d8bd043a703e08505dc3",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}