{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [10.758332032, 0.0, 0.0, 0.0, 13.419456415, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550567469643,
 "energy": -87.573688,
 "forces": {"__ndarray__": [[24, 3], "float64", [0.000239, 0.002013, 0.0, -0.000239, 0.002013, -0.0, 0.000239, 0.002013, 0.0, -0.000239, 0.002013, 0.0, -0.003327, 0.005023, 0.0, 0.003327, 0.005023, -0.0, -0.003327, 0.005023, 0.0, 0.003327, 0.005023, -0.0, -0.003262, 0.00239, 0.0, 0.003262, 0.00239, -0.0, -0.003262, 0.00239, 0.0, 0.003262, 0.00239, -0.0, 0.001065, -0.00013, -0.0, -0.001065, -0.00013, 0.0, 0.001065, -0.00013, -0.0, -0.001065, -0.00013, 0.0, 0.00218, -0.002931, -0.0, -0.00218, -0.002931, 0.0, 0.00218, -0.002931, 0.0, -0.00218, -0.002931, -0.0, -0.011661, -0.006364, 0.0, 0.011661, -0.006364, 0.0, -0.011661, -0.006364, -0.0, 0.011661, -0.006364, 0.0]]},
 "free_energy": -87.67895424,
 "key_value_pairs": {"E": 0.29122499999999985, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.143467688422106,
 "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", [2.08861, 8.33319, 10.0, 8.66972, 1.62346, 10.0, 7.46778, 8.33319, 10.0, 3.29055, 1.62346, 10.0, 0.59639, 5.86476, 10.0, 10.16194, 12.57449, 10.0, 5.97556, 5.86476, 10.0, 4.78278, 12.57449, 10.0, 1.96617, 3.59065, 10.0, 8.79216, 10.30038, 10.0, 7.34533, 3.59065, 10.0, 3.413, 10.30038, 10.0, 0.72329, 10.60603, 10.0, 10.03504, 3.8963, 10.0, 6.10245, 10.60603, 10.0, 4.65588, 3.8963, 10.0, 5.03913, 8.04075, 10.0, 5.7192, 1.33102, 10.0, 10.41829, 8.04075, 10.0, 0.34004, 1.33102, 10.0, 2.35574, 12.86654, 10.0, 8.40259, 6.15681, 10.0, 7.7349, 12.86654, 10.0, 3.02343, 6.15681, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-5.4332336940813765e-05, -5.991848760847928e-05, 0.0005784131337138533, -0.0, -0.0, -0.0]]},
 "unique_id": "ad3ce04b466944fdd0cf06fbb1c5cbf8",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}