{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [10.465137598, -0.0, 0.0, -5.232568799, 9.063075206, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550527853069,
 "energy": -59.68197399,
 "forces": {"__ndarray__": [[16, 3], "float64", [-8.4e-05, -0.000145, 0.0, 0.000167, -0.0, 0.0, -8.4e-05, 0.000145, 0.0, -0.003834, -0.00664, 0.0, 0.007667, -0.0, 0.0, -0.003834, 0.00664, 0.0, 0.0, 0.0, 0.0, -0.00052, 0.0009, 0.0, -0.00052, -0.0009, 0.0, 0.00104, -0.0, 0.0, -0.003139, -0.005585, 0.0, 0.006406, 7.4e-05, 0.0, -0.003267, 0.005511, -0.0, -0.003267, -0.005511, -0.0, -0.003139, 0.005585, 0.0, 0.006406, -7.4e-05, -0.0]]},
 "free_energy": -59.74857445,
 "key_value_pairs": {"E": 0.30274725062499996, "Au_rate": 0.625, "Si_rate": 0.375},
 "mtime": 24.982298323175492,
 "numbers": {"__ndarray__": [[16], "int32", [14, 14, 14, 14, 14, 14, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79]]},
 "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]},
 "positions": {"__ndarray__": [[16, 3], "float64", [3.98756, 6.90665, 10.0, 2.49003, -0.0, 10.0, -1.24501, 2.15643, 10.0, 2.51496, 4.35603, 10.0, 5.43523, -0.0, 10.0, -2.71761, 4.70704, 10.0, 0.0, 0.0, 10.0, -3.89113, 6.73963, 10.0, 1.34144, 2.32345, 10.0, 7.78225, -0.0, 10.0, 4.8641, 4.59641, 9.99998, 4.05249, 1.91423, 9.99998, 6.78112, 2.55244, 9.99998, 1.54856, 6.51063, 10.00002, -0.36847, 4.46667, 10.00002, -1.18008, 7.14885, 10.00002]]},
 "stress": {"__ndarray__": [[6], "float64", [-5.970003478907336e-05, -5.970003478907336e-05, 0.0005391602828211735, -0.0, -0.0, -0.0]]},
 "unique_id": "3e56b6aae8f8eb6572bb928a030f45a3",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}