{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [7.639650128, -0.0, 0.0, -0.0, 9.332284099, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325506421749132,
 "energy": -44.34407569,
 "forces": {"__ndarray__": [[12, 3], "float64", [0.007323, 0.003536, 0.0, -0.007323, -0.003536, 0.0, -0.007323, 0.003536, -0.0, 0.007323, -0.003536, -0.0, 0.001915, 0.000958, 0.0, -0.001915, -0.000958, 0.0, -0.001915, 0.000958, -0.0, 0.001915, -0.000958, -0.0, -0.006924, 0.006392, -0.0, 0.006924, -0.006392, 0.0, 0.006924, 0.006392, -0.0, -0.006924, -0.006392, 0.0]]},
 "free_energy": -44.39219359,
 "key_value_pairs": {"E": 0.24478902583333362, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.049616503716514,
 "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", [4.81192, 6.27903, 10.0, 2.82773, 3.05326, 10.0, 6.64756, 1.61288, 10.0, 0.99209, 7.7194, 10.0, 6.257, 8.51164, 10.0, 1.38265, 0.82065, 10.0, 5.20248, 3.84549, 10.0, 2.43717, 5.48679, 10.0, 0.49266, 3.43894, 10.0, 7.14699, 5.89335, 10.0, 3.32717, 8.10508, 10.0, 4.31248, 1.22721, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [3.0265077751407918e-05, 5.961889517043688e-05, 0.0006228963692540234, -0.0, -0.0, -0.0]]},
 "unique_id": "5ba883e7a96e4bdcbd247ec1efd6ef56",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}