{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [9.278514696, 0.0, 0.0, -0.0, 9.278514696, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 21.325508090912823,
 "energy": -50.37199885,
 "forces": {"__ndarray__": [[14, 3], "float64", [0.003974, 0.004573, 0.0, -0.003974, -0.004573, -0.0, 0.004573, -0.003974, 0.0, -0.004573, 0.003974, -0.0, -0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.000714, 0.004758, -0.0, -0.000714, -0.004758, 0.0, 0.004758, -0.000714, 0.0, -0.004758, 0.000714, -0.0, 0.001744, 0.001852, -0.0, -0.001744, -0.001852, 0.0, 0.001852, -0.001744, -0.0, -0.001852, 0.001744, 0.0]]},
 "free_energy": -50.42231572,
 "key_value_pairs": {"E": 0.2361379392857145, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857},
 "mtime": 25.032127694688363,
 "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", [2.90776, 1.73107, 10.0, 6.37075, 7.54744, 10.0, 1.73107, 6.37075, 10.0, 7.54744, 2.90776, 10.0, -0.0, 4.63926, 10.0, 4.63926, 0.0, 10.0, 8.76732, 7.40114, 10.0, 0.51119, 1.87737, 10.0, 7.40114, 0.51119, 10.0, 1.87737, 8.76732, 10.0, 6.51578, 5.14972, 10.0, 2.76274, 4.12879, 10.0, 5.14972, 2.76274, 10.0, 4.12879, 6.51578, 10.0]]},
 "stress": {"__ndarray__": [[6], "float64", [-3.02713192605338e-06, -3.02713192605338e-06, 0.0005240683137547878, 0.0, -0.0, -0.0]]},
 "unique_id": "b113da4ee6445a54f0a45544751ab280",
 "user": "yangxb"},
"ids": [1],
"nextid": 2}