{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [13.439470984, 0.0, 0.0, 0.0, 5.368865461, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550708503509,
 "energy": -43.79765923,
 "forces": {"__ndarray__": [[12, 3], "float64", [-0.005904, -0.005241, -0.0, 0.005904, 0.005241, 0.0, 0.005904, -0.005241, -0.0, -0.005904, 0.005241, 0.0, 0.001884, 0.000254, -0.0, -0.001884, -0.000254, -0.0, -0.001884, 0.000254, 0.0, 0.001884, -0.000254, 0.0, 0.003872, 0.003072, -0.0, -0.003872, -0.003072, -0.0, -0.003872, 0.003072, 0.0, 0.003872, -0.003072, 0.0]]},
 "free_energy": -43.84911516,
 "key_value_pairs": {"E": 0.2903237308333333, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.143696462119873,
 "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", [12.20261, 3.43801, 10.0, 1.23686, 1.93086, 10.0, 7.95659, 0.75357, 10.0, 5.48288, 4.61529, 10.0, 3.50754, 3.30269, 10.0, 9.93193, 2.06617, 10.0, 3.2122, 0.61826, 10.0, 10.22727, 4.75061, 10.0, 12.49474, 1.00578, 10.0, 0.94474, 4.36308, 10.0, 7.66447, 3.69022, 10.0, 5.775, 1.67865, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-5.530601236445154e-05, 2.8099274084726428e-05, 0.0005441659731401319, -0.0, -0.0, 0.0]]},
 "unique_id": "a125d702451bb2e49fd4e5fd348877f8",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}