{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [9.324471524, -0.0, 0.0, 0.0, 7.646244612, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325507059779895,
 "energy": -44.33885123,
 "forces": {"__ndarray__": [[12, 3], "float64", [-0.007142, -0.008499, 0.0, 0.007142, 0.008499, -0.0, -0.007142, 0.008499, -0.0, 0.007142, -0.008499, -0.0, -0.010723, -0.002762, 0.0, 0.010723, 0.002762, -0.0, -0.010723, 0.002762, -0.0, 0.010723, -0.002762, -0.0, -0.000162, -0.008727, 0.0, 0.000162, 0.008727, -0.0, -0.000162, 0.008727, -0.0, 0.000162, -0.008727, -0.0]]},
 "free_energy": -44.3864482,
 "key_value_pairs": {"E": 0.24522439749999977, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.143738253963413,
 "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", [3.05355, 6.66039, 9.99996, 6.27092, 0.98586, 9.99996, 7.71578, 4.80898, 9.99996, 1.60869, 2.83726, 9.99996, 3.43756, 4.32164, 9.99996, 5.88691, 3.32461, 9.99996, 8.0998, 7.14773, 9.99996, 1.22467, 0.49851, 9.99996, 0.82352, 5.21357, 9.99996, 8.50095, 2.43267, 9.99996, 5.48576, 6.2558, 9.99996, 3.83871, 1.39045, 9.99996]]},
 "stress": {"__ndarray__": [[6], "float64", [-7.019201162968312e-05, -7.094723423391499e-05, 0.0006505649792090637, -0.0, -0.0, -0.0]]},
 "unique_id": "8f40e0dc418666d790afad270010788e",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}