{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [13.892254001, -0.0, 0.0, -0.0, 5.25444466, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325506906254773,
 "energy": -43.22510436,
 "forces": {"__ndarray__": [[12, 3], "float64", [-0.154849, 0.056758, 0.0, 0.154849, -0.056758, 0.0, -0.154849, -0.056758, -0.0, 0.154849, 0.056758, -0.0, 0.15583, 0.172871, -0.0, -0.15583, -0.172871, -0.0, 0.15583, -0.172871, 0.0, -0.15583, 0.172871, 0.0, 0.001932, 0.058784, 0.0, -0.001932, -0.058784, 0.0, 0.001932, -0.058784, 0.0, -0.001932, 0.058784, 0.0]]},
 "free_energy": -43.28146209,
 "key_value_pairs": {"E": 0.33803663666666645, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.143513822600607,
 "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", [1.43178, 1.23713, 10.0, 12.46047, 4.01731, 10.0, 8.37791, 1.39009, 10.0, 5.51434, 3.86435, 10.0, 10.40539, 2.66962, 10.0, 3.48686, 2.58483, 10.0, 3.45926, -0.0424, 10.0, 10.43299, 0.0424, 10.0, 12.96508, 1.37816, 10.0, 0.92718, 3.87629, 10.0, 6.01895, 1.24907, 10.0, 7.8733, 4.00538, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-2.3592904495838717e-06, 0.00023070490182002288, 0.0005167719895866303, -0.0, -0.0, -0.0]]},
 "unique_id": "d311095b410c0c3597fd7ee3b6d0a753",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}