{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [7.662404178, 0.0, 0.0, 0.0, 9.307099258, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325505515666972,
 "energy": -44.34947805,
 "forces": {"__ndarray__": [[12, 3], "float64", [-0.006168, -0.008835, -0.0, 0.006168, -0.008835, 0.0, 0.009592, -0.015315, -0.0, -0.009592, -0.015315, 0.0, -0.009535, 0.009824, -0.0, 0.009535, 0.009824, 0.0, 0.012701, -0.010309, -0.0, -0.012701, -0.010309, 0.0, 0.000388, 0.033723, 0.0, -0.000388, 0.033723, -0.0, -0.001868, -0.009087, -0.0, 0.001868, -0.009087, 0.0]]},
 "free_energy": -44.39582105,
 "key_value_pairs": {"E": 0.24433882916666652, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.13759051467761,
 "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", [0.93803, 6.25562, 10.0, 6.72437, 1.60207, 10.0, 4.76939, 7.7023, 10.0, 2.89301, 3.04875, 10.0, 7.15138, 8.47612, 10.0, 0.51102, 3.82257, 10.0, 2.42501, 8.08487, 10.0, 5.23739, 3.43132, 10.0, 1.4064, 1.21686, 10.0, 6.25601, 5.87041, 10.0, 4.3447, 0.82602, 10.0, 3.31771, 5.47957, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-5.666041984476822e-05, -0.00022123653247605794, 0.0006092524303048424, -0.0, -0.0, -0.0]]},
 "unique_id": "998162c9aeef6abcd467eab461f3b0b2",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}