{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [10.661200839, 0.0, 0.0, 0.0, 13.515543858, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550557653275,
 "energy": -87.95135542,
 "forces": {"__ndarray__": [[24, 3], "float64", [0.003934, 0.002896, -0.0, -0.003934, 0.002896, -0.0, 0.003934, 0.002896, -0.0, -0.003934, 0.002896, -0.0, 0.006181, -0.007418, -0.0, -0.006181, -0.007418, -0.0, 0.006181, -0.007418, -0.0, -0.006181, -0.007418, -0.0, 0.003742, 0.002069, -0.0, -0.003742, 0.002069, 0.0, 0.003742, 0.002069, 0.0, -0.003742, 0.002069, -0.0, 0.002822, -0.002714, 0.0, -0.002822, -0.002714, -0.0, 0.002822, -0.002714, -0.0, -0.002822, -0.002714, 0.0, -0.001293, 0.003412, 0.0, 0.001293, 0.003412, -0.0, -0.001293, 0.003412, -0.0, 0.001293, 0.003412, 0.0, -0.004395, 0.001755, 0.0, 0.004395, 0.001755, -0.0, -0.004395, 0.001755, -0.0, 0.004395, 0.001755, -0.0]]},
 "free_energy": -88.054422,
 "key_value_pairs": {"E": 0.2754888575000001, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.052009348597206,
 "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", [4.43663, 3.96385, 10.00002, 6.22457, 10.72162, 9.99998, 9.76723, 3.96385, 9.99998, 0.89397, 10.72162, 10.00002, 4.43433, 13.4273, 10.00002, 6.22687, 6.66953, 9.99998, 9.76493, 13.4273, 9.99998, 0.89627, 6.66953, 10.00002, 8.38938, 1.9387, 10.00002, 2.27182, 8.69647, 9.99998, 3.05878, 1.9387, 9.99998, 7.60242, 8.69647, 10.00002, 1.62649, 12.97495, 10.00002, 9.03471, 6.21718, 9.99998, 6.95709, 12.97495, 9.99998, 3.70411, 6.21718, 10.00002, 0.43839, 1.93427, 10.00002, 10.22282, 8.69204, 9.99998, 5.76899, 1.93427, 9.99998, 4.89222, 8.69204, 10.00002, 3.70949, 11.17085, 10.00002, 6.95171, 4.41307, 9.99998, 9.04009, 11.17085, 9.99998, 1.62111, 4.41307, 10.00002]]},
 "stress": {"__ndarray__": [[6], "float64", [-1.770091988100492e-05, -3.687483591571829e-05, 0.0005640077306513147, -0.0, -0.0, -0.0]]},
 "unique_id": "6d7a60785cdb601b7c8d815218af9a2d",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}