{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [20.0, 0.0, 0.0, 0.0, 20.0, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 20.635552384225473,
 "energy": -653.33875471,
 "forces": {"__ndarray__": [[96, 3], "float64", [0.013265, 0.002566, -0.028933, -0.006163, -0.029621, 0.005253, 0.009527, 0.011439, 0.014012, -0.007044, 0.041137, -0.007289, -0.039793, -0.005035, -0.013213, -0.012952, 0.007766, 0.031799, -0.041695, 0.006921, 0.039852, -0.043328, 0.01834, -0.015192, -0.043528, 0.022693, 0.042756, -0.024972, 0.054043, 0.005289, -0.017904, 0.042359, 0.013321, -0.04974, 0.023967, -0.010647, -0.035683, 0.026057, -0.022663, -0.01188, 0.04305, 0.023718, -0.039002, 0.006206, 0.014972, -0.014657, 0.0282, 0.018596, -0.023414, 0.029993, -0.018255, -0.041071, -0.000405, 0.012966, 0.014657, -0.0282, -0.018596, 0.041071, 0.000405, -0.012966, 0.023414, -0.029993, 0.018255, 0.035683, -0.026057, 0.022663, 0.039002, -0.006206, -0.014972, 0.01188, -0.04305, -0.023718, 0.043528, -0.022693, -0.042756, 0.04974, -0.023967, 0.010647, 0.041695, -0.006921, -0.039852, 0.017904, -0.042359, -0.013321, 0.043328, -0.01834, 0.015192, 0.024972, -0.054043, -0.005289, 0.039793, 0.005035, 0.013213, 0.012952, -0.007766, -0.031799, 0.007044, -0.041137, 0.007289, -0.013265, -0.002566, 0.028933, -0.009527, -0.011439, -0.014012, 0.006163, 0.029621, -0.005253, 0.049777, 0.05752, 0.016763, -0.027536, -0.039388, 0.012197, -0.027471, -0.024407, 0.017499, -0.024909, 0.000924, -0.036731, 0.006629, -0.002601, 0.022656, 0.012584, 0.006221, -0.002573, 0.044346, -0.060986, -0.003582, 0.05092, -0.000293, 0.049087, -0.044563, -0.065194, -0.019098, 0.044395, -0.033498, -0.064303, 0.08584, -0.014153, 0.001907, 0.024249, 0.056267, -0.046381, -0.006857, 0.015801, -0.031246, -0.034111, -0.022701, 0.012183, 0.001368, 0.017649, 0.0311, -0.063677, -0.021907, -0.028097, 0.016872, 0.085243, -0.021095, 0.025148, -0.016792, -0.064746, 0.012128, -0.048124, 0.013783, -0.028102, -0.012337, 0.089883, 0.063055, -0.005725, 0.015301, 0.073183, -0.010213, -0.015417, 0.061394, -0.040579, 0.013136, 0.038482, -0.065208, -0.014229, 0.084722, 0.044722, 0.027864, 0.025159, 0.064636, -0.014232, 0.020073, -0.033367, -0.092687, -0.022263, -0.022259, 0.061918, -0.053615, -0.004927, -0.024708, -0.001139, -0.084332, 0.040463, 0.022263, 0.022259, -0.061918, 0.053615, 0.004927, 0.024708, -0.084722, -0.044722, -0.027864, 0.001139, 0.084332, -0.040463, -0.020073, 0.033367, 0.092687, -0.025159, -0.064636, 0.014232, -0.073183, 0.010213, 0.015417, -0.038482, 0.065208, 0.014229, -0.061394, 0.040579, -0.013136, -0.025148, 0.016792, 0.064746, -0.063055, 0.005725, -0.015301, 0.063677, 0.021907, 0.028097, 0.028102, 0.012337, -0.089883, -0.016872, -0.085243, 0.021095, -0.012128, 0.048124, -0.013783, 0.034111, 0.022701, -0.012183, -0.001368, -0.017649, -0.0311, 0.006857, -0.015801, 0.031246, 0.044563, 0.065194, 0.019098, -0.024249, -0.056267, 0.046381, -0.08584, 0.014153, -0.001907, -0.05092, 0.000293, -0.049087, -0.044395, 0.033498, 0.064303, -0.044346, 0.060986, 0.003582, 0.027471, 0.024407, -0.017499, -0.012584, -0.006221, 0.002573, -0.006629, 0.002601, -0.022656, 0.024909, -0.000924, 0.036731, -0.049777, -0.05752, -0.016763, 0.027536, 0.039388, -0.012197]]},
 "free_energy": -653.33875471,
 "key_value_pairs": {"perms_num": 6},
 "mtime": 24.988041842872228,
 "numbers": {"__ndarray__": [[96], "int32", [1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6]]},
 "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]},
 "positions": {"__ndarray__": [[96, 3], "float64", [6.53419, 11.30405, 12.52473, 8.04008, 13.97045, 10.69371, 5.93812, 11.62131, 9.02208, 10.37646, 14.21265, 12.36158, 7.238, 11.81199, 6.45711, 6.24329, 8.44021, 12.63227, 8.23684, 9.82866, 14.82168, 5.81229, 8.96697, 7.21045, 9.55986, 11.86529, 14.68957, 9.51366, 14.21975, 7.24099, 10.69077, 15.02856, 9.20928, 5.42904, 7.91043, 9.36754, 9.2107, 11.16841, 5.42179, 12.3461, 13.07949, 12.82338, 7.38683, 6.52143, 12.00664, 11.70532, 11.0058, 14.52066, 11.15537, 12.9463, 6.21612, 6.96295, 6.17457, 9.30506, 8.29468, 8.9942, 5.47934, 13.03705, 13.82543, 10.69494, 8.84463, 7.0537, 13.78388, 10.7893, 8.83159, 14.57821, 12.61317, 13.47857, 7.99336, 7.6539, 6.92051, 7.17662, 10.44014, 8.13471, 5.31043, 14.57096, 12.08957, 10.63246, 11.76316, 10.17134, 5.17832, 9.30923, 4.97144, 10.79072, 14.18771, 11.03303, 12.78955, 10.48634, 5.78025, 12.75901, 12.762, 8.18801, 13.54289, 13.75671, 11.55979, 7.36773, 9.62354, 5.78735, 7.63842, 13.46581, 8.69595, 7.47527, 14.06188, 8.37869, 10.97792, 11.95992, 6.02955, 9.30629, 8.34304, 12.11937, 11.74816, 6.88028, 10.49135, 10.56383, 7.38712, 11.02416, 11.86008, 7.93919, 12.35888, 9.30298, 8.47485, 12.95641, 10.52113, 6.94718, 11.24605, 9.31667, 9.96675, 13.21063, 10.42666, 8.51983, 12.50747, 8.112, 9.38673, 12.25119, 12.56827, 7.98807, 9.80501, 12.53267, 7.37139, 10.38128, 8.14567, 6.68437, 9.17279, 10.5981, 10.39708, 13.19946, 11.91328, 7.98481, 11.41935, 7.17557, 7.11019, 8.65791, 11.97695, 8.66562, 10.01585, 13.82385, 6.62884, 9.12623, 7.93392, 9.65167, 11.32323, 13.73593, 9.75148, 13.36, 7.88637, 10.44787, 13.95383, 9.24764, 6.4454, 8.33425, 9.35877, 9.12037, 10.75868, 6.44796, 11.77821, 12.61549, 11.99198, 7.97841, 7.44189, 11.82616, 11.12358, 10.73789, 13.61827, 11.44041, 12.86458, 9.56431, 10.87446, 12.48588, 7.18202, 9.45272, 9.00571, 13.02943, 8.08589, 8.87171, 7.64568, 7.49615, 7.14381, 9.31943, 10.54728, 10.99429, 6.97057, 11.91411, 11.12829, 12.35432, 8.87642, 9.26211, 6.38173, 12.50385, 12.85619, 10.68057, 9.12554, 7.51412, 12.81798, 8.55959, 7.13542, 10.43569, 10.87963, 9.24132, 13.55204, 12.02159, 12.55811, 8.17384, 8.22179, 7.38451, 8.00802, 10.34833, 8.67677, 6.26407, 13.5546, 11.66575, 10.64123, 11.33438, 9.98415, 6.17615, 9.55213, 6.04617, 10.75236, 13.37116, 10.87377, 12.06608, 10.24852, 6.64, 12.11363, 12.01519, 8.58065, 12.82443, 12.88981, 11.34209, 8.02305, 9.60292, 6.80054, 8.08672, 10.61327, 7.74881, 7.43173, 13.31563, 10.82721, 9.4019, 12.62861, 9.61872, 11.85433, 11.48017, 7.49253, 11.888, 12.01193, 10.19499, 7.46733, 10.03325, 6.78937, 9.57334, 12.61288, 8.97584, 8.13992, 13.05282, 8.75395, 10.68333, 11.52515, 7.04359, 9.47887, 12.06081, 7.64112, 10.69702, 11.65696, 7.88063, 8.25184, 13.11972, 9.50865, 9.43617]]},
 "stress": {"__ndarray__": [[6], "float64", [-7.845576971235256e-06, -4.847155987160939e-05, -4.7204533519055084e-05, 1.0591840986623889e-05, -7.733229806969358e-06, -6.157872903596422e-05]]},
 "unique_id": "c7aacd3571b6b373f195eaf8ec263da1",
 "user": "mse-gucc"},
"ids": [1],
"nextid": 2}