{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [10.661166746, 0.0, 0.0, 0.0, 13.512049664, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325506104915124,
 "energy": -87.95691686,
 "forces": {"__ndarray__": [[24, 3], "float64", [-0.000862, -0.001163, -0.0, 0.000862, -0.001163, 0.0, -0.000862, 0.001163, 0.0, 0.000862, 0.001163, -0.0, 0.000862, 0.001163, -0.0, -0.000862, 0.001163, -0.0, 0.000862, -0.001163, -0.0, -0.000862, -0.001163, 0.0, 0.008742, -0.0, 0.0, -0.008742, -0.0, -0.0, 0.008742, -0.0, -0.0, -0.008742, -0.0, 0.0, -0.006123, 0.002561, 0.0, 0.006123, 0.002561, -0.0, -0.006123, -0.002561, -0.0, 0.006123, -0.002561, -0.0, 0.006123, -0.002561, 0.0, -0.006123, -0.002561, 0.0, 0.006123, 0.002561, 0.0, -0.006123, 0.002561, -0.0, -0.001383, -0.0, 0.0, 0.001383, -0.0, -0.0, -0.001383, -0.0, -0.0, 0.001383, -0.0, 0.0]]},
 "free_energy": -88.05981045,
 "key_value_pairs": {"E": 0.2752571308333331, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.143532127081784,
 "numbers": {"__ndarray__": [[24], "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]]},
 "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]},
 "positions": {"__ndarray__": [[24, 3], "float64", [3.55941, 12.16047, 10.0, 7.10176, 5.40444, 10.0, 8.88999, 8.10761, 10.0, 1.77117, 1.35158, 10.0, 7.10176, 1.35158, 10.0, 3.55941, 8.10761, 10.0, 1.77117, 5.40444, 10.0, 8.88999, 12.16047, 10.0, 4.93792, 10.13404, 10.0, 5.72325, 3.37801, 10.0, 10.2685, 10.13404, 10.0, 0.39266, 3.37801, 10.0, 6.37175, 12.60967, 10.0, 4.28941, 5.85365, 10.0, 1.04117, 7.6584, 10.0, 9.62, 0.90238, 10.0, 4.28941, 0.90238, 10.0, 6.37175, 7.6584, 10.0, 9.62, 5.85365, 10.0, 1.04117, 12.60967, 10.0, 3.10252, 3.37801, 10.0, 7.55865, 10.13404, 10.0, 8.4331, 3.37801, 10.0, 2.22806, 10.13404, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [5.342731811756068e-06, -2.5527772324862526e-05, 0.0005540712481229086, -0.0, -0.0, 0.0]]},
 "unique_id": "52c131a0559e17263d249adfff384cdb",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}