{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [8.891596582, 0.0, 0.0, 0.0, 8.0881978, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.32550618718565,
 "energy": -43.75361297,
 "forces": {"__ndarray__": [[12, 3], "float64", [0.0, 0.006147, 0.0, 0.0, -0.006147, -0.0, 0.0, 0.00233, -0.0, 0.0, -0.00233, 0.0, 0.0, -0.007749, 0.0, 0.0, 0.007749, -0.0, 0.0, -0.0, -0.0, 0.0, -0.0, -0.0, -0.002316, -0.001988, 0.0, 0.002316, 0.001988, -0.0, -0.002316, 0.001988, -0.0, 0.002316, -0.001988, -0.0]]},
 "free_energy": -43.80097205,
 "key_value_pairs": {"E": 0.2939942525000001, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333},
 "mtime": 25.085842227061644,
 "numbers": {"__ndarray__": [[12], "int32", [14, 14, 14, 14, 79, 79, 79, 79, 79, 79, 79, 79]]},
 "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]},
 "positions": {"__ndarray__": [[12, 3], "float64", [2.2229, 5.13229, 10.0, 6.6687, 2.9559, 10.0, 6.6687, 7.93346, 10.0, 2.2229, 0.15474, 10.0, 6.6687, 5.59018, 10.0, 2.2229, 2.49802, 10.0, 4.4458, 4.0441, 10.0, -0.0, 4.0441, 10.0, 8.53209, 1.32235, 10.0, 0.35951, 6.76585, 10.0, 4.08629, 6.76585, 10.0, 4.8053, 1.32235, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [7.708263770465824e-05, -4.874618627314824e-06, 0.0005126650765817991, -0.0, -0.0, 0.0]]},
 "unique_id": "ce9e9415873875062250e244d2ef51db",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}