{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [16.232968831, -0.0, 0.0, 0.0, 8.87496339, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550621502651,
 "energy": -87.4675621,
 "forces": {"__ndarray__": [[24, 3], "float64", [-0.002118, 0.0, 0.0, 0.002118, -0.0, -0.0, 0.002118, -0.0, -0.0, -0.002118, 0.0, -0.0, -7.3e-05, 0.0, 0.0, 7.3e-05, -0.0, 0.0, 7.3e-05, -0.0, 0.0, -7.3e-05, 0.0, 0.0, 0.005312, -0.00617, -0.0, 0.005312, 0.00617, 0.0, -0.005312, 0.00617, 0.0, -0.005312, -0.00617, -0.0, -0.005312, 0.00617, -0.0, -0.005312, -0.00617, 0.0, 0.005312, -0.00617, -0.0, 0.005312, 0.00617, 0.0, -0.007546, 0.0, 0.0, 0.007546, -0.0, -0.0, 0.007546, -0.0, -0.0, -0.007546, 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, 0.0]]},
 "free_energy": -87.57496709,
 "key_value_pairs": {"E": 0.29564691250000025, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.1435613048648,
 "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", [7.95139, 6.65622, 10.0, 0.1651, 2.21874, 10.0, 8.28158, 2.21874, 10.0, 16.06787, 6.65622, 10.0, 5.14582, 2.21874, 10.0, 2.97066, 6.65622, 10.0, 11.08715, 6.65622, 10.0, 13.2623, 2.21874, 10.0, 9.44148, 4.8029, 10.0, 9.44148, 8.50955, 10.0, 14.90797, 4.07207, 10.0, 14.90797, 0.36541, 10.0, 6.79149, 4.07207, 10.0, 6.79149, 0.36541, 10.0, 1.325, 4.8029, 10.0, 1.325, 8.50955, 10.0, 13.7253, 6.65622, 10.0, 10.62416, 2.21874, 10.0, 2.50767, 2.21874, 10.0, 5.60881, 6.65622, 10.0, 4.05824, 0.0, 10.0, 4.05824, 4.43748, 10.0, 12.17473, -0.0, 10.0, 12.17473, 4.43748, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-1.2027388085577038e-05, -4.798472215979049e-05, 0.000521490570485798, -0.0, -0.0, -0.0]]},
 "unique_id": "a87330dce91e9283d9cf2a6af13c732c",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}