{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [9.278432363, 0.0, 0.0, 0.0, 9.278432363, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325505191026142,
 "energy": -50.37665349,
 "forces": {"__ndarray__": [[14, 3], "float64", [0.000882, 0.000882, 0.0, -0.000882, -0.000882, 0.0, 0.000882, -0.000882, 0.0, -0.000882, 0.000882, 0.0, -0.002411, 0.005398, 0.0, 0.002411, -0.005398, -0.0, 0.005398, 0.002411, -0.0, -0.005398, -0.002411, -0.0, -0.002411, -0.005398, 0.0, 0.002411, 0.005398, -0.0, 0.005398, -0.002411, -0.0, -0.005398, 0.002411, 0.0, -0.0, 0.0, 0.0, 0.0, -0.0, 0.0]]},
 "free_energy": -50.42704056,
 "key_value_pairs": {"E": 0.23580546499999983, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857},
 "mtime": 24.98235417844917,
 "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", [7.54779, 2.90857, 10.0, 1.73065, 6.36986, 10.0, 2.90857, 1.73065, 10.0, 6.36986, 7.54779, 10.0, 1.87714, 8.76625, 10.0, 7.4013, 0.51218, 10.0, 8.76625, 7.4013, 10.0, 0.51218, 1.87714, 10.0, 6.51635, 5.1514, 10.0, 2.76208, 4.12703, 10.0, 4.12703, 6.51635, 10.0, 5.1514, 2.76208, 10.0, 4.63922, -0.0, 10.0, 0.0, 4.63922, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [8.226309027914134e-06, 8.226309027914134e-06, 0.000510636586115887, -0.0, -0.0, -0.0]]},
 "unique_id": "93055355c0747d92bff605888fbdebd9",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}