{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [9.279525657, -0.0, 0.0, -0.0, 9.277809947, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325507622737717,
 "energy": -50.37407309,
 "forces": {"__ndarray__": [[14, 3], "float64", [0.008087, -0.004715, 0.0, -0.008087, 0.004715, 0.0, -0.008087, -0.004715, -0.0, 0.008087, 0.004715, -0.0, 0.007173, -0.000323, 0.0, -0.007173, 0.000323, -0.0, -0.007173, -0.000323, -0.0, 0.007173, 0.000323, 0.0, -0.002153, 0.000409, -0.0, 0.002153, -0.000409, 0.0, 0.002153, 0.000409, 0.0, -0.002153, -0.000409, -0.0, -0.0, 0.0, -0.0, -0.0, 0.0, -0.0]]},
 "free_energy": -50.4243998,
 "key_value_pairs": {"E": 0.23598977928571405, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857},
 "mtime": 25.103274068877713,
 "numbers": {"__ndarray__": [[14], "int32", [14, 14, 14, 14, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79]]},
 "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]},
 "positions": {"__ndarray__": [[14, 3], "float64", [6.36869, 6.37037, 10.0, 2.91084, 2.90744, 10.0, 7.5506, 1.73147, 10.0, 1.72893, 7.54634, 10.0, 4.12532, 7.40009, 10.0, 5.15421, 1.87772, 10.0, 0.51444, 2.76118, 10.0, 8.76508, 6.51663, 10.0, 7.40436, 4.12804, 10.0, 1.87516, 5.14977, 10.0, 6.51493, 8.76694, 10.0, 2.7646, 0.51087, 10.0, 0.0, 0.0, 10.0, 4.63976, 4.6389, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [2.1826557413213752e-05, -3.0564670189450317e-05, 0.0004970113716940838, -0.0, -0.0, 0.0]]},
 "unique_id": "c2b580b175f376719e6e287b6c98d94a",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}