{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [13.118559971, 2e-09, 0.0, -2e-09, 13.118559971, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550810651776,
 "energy": -100.81463717,
 "forces": {"__ndarray__": [[28, 3], "float64", [-0.004908, -0.004358, -0.0, 0.004908, 0.004358, 0.0, 0.004358, -0.004908, 0.0, -0.004358, 0.004908, 0.0, 0.004908, 0.004358, 0.0, -0.004908, -0.004358, 0.0, -0.004358, 0.004908, -0.0, 0.004358, -0.004908, 0.0, -0.000658, -0.002277, 0.0, 0.000658, 0.002277, 0.0, 0.002277, -0.000658, 0.0, -0.002277, 0.000658, -0.0, 0.000658, 0.002277, -0.0, -0.000658, -0.002277, 0.0, -0.002277, 0.000658, -0.0, 0.002277, -0.000658, -0.0, -0.0, -0.0, 0.0, 0.0, -0.0, 0.0, -0.0, -0.0, 0.0, 0.0, -0.0, 0.0, 0.000507, -0.003295, -0.0, -0.000507, 0.003295, 0.0, 0.003295, 0.000507, -0.0, -0.003295, -0.000507, -0.0, -0.000507, 0.003295, -0.0, 0.000507, -0.003295, -0.0, -0.003295, -0.000507, -0.0, 0.003295, 0.000507, -0.0]]},
 "free_energy": -100.89239365,
 "key_value_pairs": {"E": 0.23361510107142866, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857},
 "mtime": 24.9823626994277,
 "numbers": {"__ndarray__": [[28], "int32", [14, 14, 14, 14, 14, 14, 14, 14, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79]]},
 "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]},
 "positions": {"__ndarray__": [[28, 3], "float64", [12.29168, 9.83924, 10.0, 0.82688, 3.27932, 10.0, 3.27932, 12.29168, 10.0, 9.83924, 0.82688, 10.0, 7.38616, 9.8386, 10.0, 5.7324, 3.27996, 10.0, 3.27996, 7.38616, 10.0, 9.8386, 5.7324, 10.0, 0.96961, 11.43111, 10.0, 12.14895, 1.68745, 10.0, 1.68745, 0.96961, 10.0, 11.43111, 12.14895, 10.0, 5.58967, 8.24673, 10.0, 7.52889, 4.87183, 10.0, 4.87183, 5.58967, 10.0, 8.24673, 7.52889, 10.0, 9.83892, 9.83892, 10.0, 3.27964, 3.27964, 10.0, 3.27964, 9.83892, 10.0, 9.83892, 3.27964, 10.0, 11.43048, 7.52948, 10.0, 1.68808, 5.58908, 10.0, 5.58908, 11.43048, 10.0, 7.52948, 1.68808, 10.0, 8.24736, 12.14836, 10.0, 4.8712, 0.9702, 10.0, 0.9702, 8.24736, 10.0, 12.14836, 4.8712, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-1.3107169164354842e-06, -1.3107169164354842e-06, 0.00045186653618657023, -0.0, 0.0, 0.0]]},
 "unique_id": "e8f083f4ffc269965847546d845abd26",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}