{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [-0.020498199, 3.6306389, 3.6306389, 3.610140701, -0.0, 3.610140701, 3.610140701, 3.610140701, 0.0]]},
 "ctime": 20.452077436252797,
 "energy": -136.77127876,
 "forces": {"__ndarray__": [[16, 3], "float64", [-0.003095, 0.003095, 0.003095, -0.0001, 0.0001, -0.000615, -0.0001, -0.000615, 0.0001, 0.000615, 0.0001, 0.0001, 0.001653, 0.000318, 0.000318, -0.000318, -0.001653, 0.000318, -0.000318, 0.000318, -0.001653, 0.004617, -0.004617, -0.004617, 0.002455, -0.002455, -0.002455, -0.000253, 0.000253, 0.001293, -0.000253, 0.001293, 0.000253, -0.001293, 0.000253, 0.000253, 0.000955, 0.000792, 0.000792, -0.000792, -0.000955, 0.000792, -0.000792, 0.000792, -0.000955, -0.00298, 0.00298, 0.00298]]},
 "free_energy": -136.77127876,
 "key_value_pairs": {"gap": 1.808088999999999, "C_rate": 0.5, "mean_energy": 0.3614513275000002},
 "mtime": 25.648618546530617,
 "numbers": {"__ndarray__": [[16], "int32", [5, 5, 5, 5, 6, 6, 6, 6, 6, 6, 6, 6, 7, 7, 7, 7]]},
 "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]},
 "positions": {"__ndarray__": [[16, 3], "float64", [7.18866, 3.64176, 3.64176, 5.39456, 1.82572, 3.60144, 5.39456, 3.60144, 1.82572, 3.61884, 1.82572, 1.82572, 7.20307, 5.39548, 5.39548, 5.43494, 3.62735, 5.39548, 5.43494, 5.39548, 3.62735, 3.62149, 3.59879, 3.59879, 4.48923, 2.73105, 2.73105, 2.71808, 4.5022, 2.71892, 2.71808, 2.71892, 4.5022, 4.50136, 4.5022, 4.5022, 0.88603, 0.92867, 0.92867, 2.68147, 2.72411, 0.92867, 2.68147, 0.92867, 2.72411, 0.91326, 2.69688, 2.69688]]},
 "stress": {"__ndarray__": [[6], "float64", [9.308586710342291e-05, 9.308586710342291e-05, 9.308586710342291e-05, -3.459044357564502e-05, 3.459044357564502e-05, 3.459044357564502e-05]]},
 "unique_id": "f3f0e5f029c53bf545213da4e3bd2f14",
 "user": "mse-gucc"},
"ids": [1],
"nextid": 2}