{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [10.757895584, 0.0, 0.0, 0.0, 13.422552923, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550557368225,
 "energy": -87.56493209,
 "forces": {"__ndarray__": [[24, 3], "float64", [-0.003631, 0.003251, -0.0, 0.003631, 0.003251, 0.0, -0.003631, 0.003251, -0.0, 0.003631, 0.003251, -0.0, -0.004083, -0.002217, -0.0, 0.004083, -0.002217, 0.0, -0.004083, -0.002217, 0.0, 0.004083, -0.002217, -0.0, 0.002305, 0.0078, 0.0, -0.002305, 0.0078, 0.0, 0.002305, 0.0078, 0.0, -0.002305, 0.0078, -0.0, 0.004072, -0.007471, 0.0, -0.004072, -0.007471, 0.0, 0.004072, -0.007471, 0.0, -0.004072, -0.007471, 0.0, 0.004099, -0.001892, 0.0, -0.004099, -0.001892, -0.0, 0.004099, -0.001892, 0.0, -0.004099, -0.001892, 0.0, -0.006164, 0.000529, -0.0, 0.006164, 0.000529, -0.0, -0.006164, 0.000529, 0.0, 0.006164, 0.000529, 0.0]]},
 "free_energy": -87.67091708,
 "key_value_pairs": {"E": 0.2915898295833334, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.14356202763017,
 "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", [0.59526, 7.56454, 9.99998, 10.16264, 0.85328, 10.00002, 5.97421, 7.56454, 10.00002, 4.78369, 0.85328, 9.99998, 8.66541, 11.80221, 9.99998, 2.09249, 5.09094, 10.00002, 3.28646, 11.80221, 10.00002, 7.47143, 5.09094, 9.99998, 2.35447, 0.55752, 9.99998, 8.40343, 7.26879, 10.00002, 7.73341, 0.55752, 10.00002, 3.02448, 7.26879, 9.99998, 10.42079, 5.38712, 9.99998, 0.3371, 12.09839, 10.00002, 5.04185, 5.38712, 10.00002, 5.71605, 12.09839, 9.99998, 1.96088, 9.83465, 9.99998, 8.79702, 3.12337, 10.00002, 7.33983, 9.83465, 10.00002, 3.41807, 3.12337, 9.99998, 0.72851, 2.82176, 9.99998, 10.02938, 9.53304, 10.00002, 6.10746, 2.82176, 10.00002, 4.65044, 9.53304, 9.99998]]},
 "stress": {"__ndarray__": [[6], "float64", [-2.2544330962690328e-05, 3.061460226245738e-05, 0.0005961452611404877, -0.0, -0.0, -0.0]]},
 "unique_id": "b8378cb06a140112124c9606e4c6e8dc",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}