{"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": 20.636159197574152,
 "energy": -610.74184289,
 "forces": {"__ndarray__": [[84, 3], "float64", [0.010055, -0.003886, 0.029364, -0.000627, -0.001528, -0.020998, 0.012048, -0.006635, 0.001167, 0.078328, -0.057802, 0.014695, 0.028782, 0.017676, 0.007502, -0.022017, -0.014382, -0.020651, 0.033109, 0.004073, 0.005936, -0.002106, -0.008021, -0.006575, -0.000979, -0.008659, 0.01327, -0.078844, -0.02084, 0.008475, -0.016178, 0.003561, -0.007714, -0.001884, 0.012853, 0.012978, 0.017257, -0.002368, -0.006408, -0.015884, -0.020551, -0.02184, 0.002725, -0.013394, -0.009844, 0.002083, 0.009975, -0.017722, 0.007688, 0.012378, -0.007983, -0.003754, 0.009158, 0.005985, 0.011842, 0.002842, 0.008251, -0.020899, 0.029674, -0.020345, -0.011145, -0.002539, -0.016992, 0.027838, -0.001041, 0.021468, -0.031344, 0.027789, -0.002818, -0.001719, 0.010588, 0.005796, -0.058176, -0.004504, 0.006037, 0.012279, 0.002877, -0.007565, -0.024072, 0.030197, -0.053656, 0.060565, -0.009089, 0.024438, 0.038151, 0.035591, -0.00136, 0.043218, -0.025879, 0.01239, -0.008943, -0.007697, -0.012531, 0.003707, 0.009299, -0.001826, 0.02028, -0.001963, -0.000731, 0.010959, 0.018372, -0.014757, -0.000923, 0.015278, 0.033451, 0.026232, -0.002413, -0.0616, 0.05154, 0.018367, -0.00902, 0.027274, -0.00036, -0.034862, -0.007504, -0.007383, 0.00023, 0.003588, -0.023891, -0.016135, -0.015546, -0.015649, 0.006234, 0.001931, 0.018057, 0.018317, -0.009058, 0.008559, 0.024107, -0.059927, -0.073257, 0.00318, 0.019731, 0.01446, 0.059238, 0.032909, 0.047567, -0.005534, -0.020342, 0.02019, -0.001522, -0.00883, -0.002114, -0.047313, 0.008116, -0.005858, -0.040788, -0.048543, -0.001643, 0.054239, -0.061429, -0.033543, -0.071668, 0.067412, -0.021105, 0.006214, 0.013429, -0.017004, -0.003459, -0.00022, -0.00651, -0.015274, 0.006601, 0.008064, 0.001894, -0.023114, -0.033393, 0.009339, -0.005045, 0.022962, 0.018702, -0.044271, 0.031348, 0.009405, 0.051337, 0.028547, 0.022045, -0.021271, 0.011628, -0.011391, 0.013649, -0.005121, 0.003936, 0.027651, -0.027509, 0.022757, -0.000369, -0.035085, 0.061956, 0.009735, -0.015147, -0.005773, -0.022317, 0.008037, 0.015701, -0.017741, 0.03009, 0.011226, -0.023899, 0.003453, -0.001282, 0.016268, 0.006643, -0.007559, 0.004871, -0.000309, -0.061648, -0.049126, 0.021758, 0.027671, -0.008765, -0.005349, -0.021388, -0.031731, -0.000218, 0.006311, -0.06258, 0.011566, -0.017246, -0.014806, -0.02357, 0.010767, -0.006847, 0.0, 0.012548, -0.025119, -0.002558, 0.008133, 0.003946, -0.017243, 0.030513, 0.026373, 0.020333, 0.02004, -0.011486, -0.005674, 0.014597, 0.025296, 0.034718, -0.06393, -0.006652, 0.008595, 0.020965, -0.015501, -0.019239, 0.031143, 0.085662, 0.049589, 0.032848, -0.022934, -0.064786, -0.025752]]},
 "free_energy": -610.91682523,
 "key_value_pairs": {"perms_num": 1},
 "mtime": 25.58670124465581,
 "numbers": {"__ndarray__": [[84], "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, 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__": [[84, 3], "float64", [7.41369, 13.29851, 12.48725, 5.1943, 10.97361, 10.69712, 6.14232, 11.53051, 12.68006, 6.68311, 13.62453, 9.12707, 9.48012, 14.91187, 10.89656, 7.20194, 12.03974, 6.56929, 9.71434, 14.28277, 7.40249, 8.55711, 10.84042, 5.34651, 12.11645, 13.61314, 12.65848, 12.25187, 14.18604, 9.03346, 9.32742, 8.46494, 14.64701, 6.67522, 6.38757, 9.29547, 10.66404, 11.67888, 5.37728, 13.38569, 13.50711, 10.7801, 8.94296, 6.70113, 13.41326, 11.52422, 9.02919, 14.61756, 7.78252, 6.49346, 7.31874, 9.42942, 5.09388, 10.87393, 9.84954, 5.81322, 7.53188, 12.27227, 6.36771, 12.59559, 13.83249, 8.31655, 7.34424, 14.31145, 7.95792, 10.9729, 12.44688, 5.72793, 9.10761, 14.804, 9.15605, 9.21375, 7.90623, 12.48687, 11.89513, 6.28271, 10.78416, 10.62904, 6.95081, 11.25426, 11.98471, 7.4671, 12.83446, 9.32741, 8.24374, 13.07563, 10.56745, 6.83265, 11.43849, 9.38888, 9.57178, 13.8146, 10.66101, 8.43135, 12.65398, 8.16528, 9.30198, 12.29383, 12.47443, 7.6289, 9.99887, 12.51112, 7.12523, 10.73668, 8.26887, 6.57035, 9.27614, 10.5858, 10.22349, 13.04142, 11.82408, 7.92808, 11.56554, 7.27477, 7.25686, 8.87349, 11.76119, 8.81521, 10.00262, 13.24595, 7.1175, 9.29857, 8.23624, 9.65104, 11.12874, 13.24491, 9.74008, 13.33193, 8.00757, 10.30768, 13.48678, 9.41472, 6.79857, 8.57027, 9.41253, 8.93272, 10.77243, 6.37922, 11.70455, 12.82206, 12.00319, 8.10204, 7.70987, 11.72757, 11.00951, 10.7255, 13.33305, 11.77967, 13.2256, 9.36771, 10.74934, 12.32604, 7.42302, 9.58925, 8.7463, 13.61491, 8.0816, 8.60771, 7.48901, 7.44649, 7.1784, 9.36986, 10.43263, 11.28088, 6.38338, 11.95404, 11.43132, 12.60247, 9.04391, 9.30219, 6.75356, 12.54463, 12.80492, 10.66106, 9.24686, 7.519, 12.71233, 8.27147, 6.96174, 10.61241, 11.10103, 9.21735, 13.61171, 11.85826, 12.26091, 8.19361, 8.26902, 7.19352, 8.01614, 10.38224, 8.88339, 6.75634, 13.10161, 11.39159, 10.59475, 11.24465, 10.00714, 6.6666, 9.60321, 6.19035, 10.67674, 12.86247, 10.70135, 11.79171, 10.28818, 6.9353, 11.81561, 11.96972, 8.55834, 12.57054, 12.72999, 11.116, 8.20856, 9.76614, 6.76477, 8.11566, 10.78122, 7.7396, 7.53375, 13.32902, 10.69698, 9.40565, 12.83327, 9.26294, 11.80357, 11.74592, 7.15523, 11.98172, 12.42328, 9.99198, 7.39743, 10.37852, 6.49212, 9.45029, 13.03702, 8.71869, 8.00015, 13.35686, 8.43409, 10.63812, 11.88578, 6.67697, 9.35106, 12.33505, 7.34908, 10.59259, 11.96298, 7.6779, 8.18691, 13.71221, 9.22706, 9.33931]]},
 "stress": {"__ndarray__": [[6], "float64", [0.00026394093791535123, 0.00021070710658069292, 0.00018321950039030304, -2.9547304201931345e-05, -1.0529425895365057e-05, -5.149245028853688e-06]]},
 "unique_id": "888b77edc19cd54f89e0f9f76bda47c2",
 "user": "mse-gucc"},
"ids": [1],
"nextid": 2}