{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [-0.001431893, 3.632757846, 3.630035296, 3.632830618, -0.001504666, 3.630107703, 3.631325952, 3.631325952, 0.0]]},
 "ctime": 20.452076881198586,
 "energy": -131.29651356,
 "forces": {"__ndarray__": [[16, 3], "float64", [0.000184, -0.006812, -0.002738, 0.006812, -0.000184, -0.002738, 0.001615, -0.001615, -0.001761, 0.00121, -0.001987, 0.000852, 0.001987, -0.00121, 0.000852, 0.000211, -0.000211, -0.004277, -0.003241, 0.003241, 0.002078, -0.004565, 0.007767, 0.001351, -0.007767, 0.004565, 0.001351, 0.00078, -0.005196, 0.00286, 0.005196, -0.00078, 0.00286, 0.003567, -0.003567, 0.002554, -0.001976, 0.001976, -0.000928, 0.002632, -0.002632, 0.004419, -0.001164, 0.001164, -0.007227, -0.005481, 0.005481, 0.000492]]},
 "free_energy": -131.2967282,
 "key_value_pairs": {"gap": 0.29513699999999865, "C_rate": 0.625, "mean_energy": 0.7496007150000015},
 "mtime": 25.571205152239454,
 "numbers": {"__ndarray__": [[16], "int32", [5, 5, 5, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 7, 7, 7]]},
 "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]},
 "positions": {"__ndarray__": [[16, 3], "float64", [3.63402, 0.02797, 3.64313, 5.41902, 1.81297, 3.64313, 5.43463, 3.64368, 1.81537, 1.84763, 1.81557, 3.61284, 3.63142, 3.59936, 3.61284, 0.901, 0.91466, 0.9212, 2.72873, 2.71826, 0.90292, 2.71564, 0.91734, 2.7259, 4.52965, 2.73135, 2.7259, 0.90797, 2.7144, 2.73833, 2.73259, 4.53902, 2.73833, 2.71908, 2.7279, 4.52435, 4.53499, 4.54333, 4.51455, 3.61477, 1.83222, 1.84555, 0.0238, 1.79186, 1.7823, 1.83565, 3.61133, 1.81429]]},
 "stress": {"__ndarray__": [[6], "float64", [3.31424134584401e-05, 3.31424134584401e-05, 3.764254153820193e-05, 3.668759064194179e-05, -3.668759064194179e-05, -9.026470497852368e-05]]},
 "unique_id": "79d8428964ccdb24e07569fc61a223c7",
 "user": "mse-gucc"},
"ids": [1],
"nextid": 2}