{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [15.255827134, 0.647924286, 0.090208788, 0.646372253, 16.296085454, 0.249244961, 0.088759538, 0.249649284, 16.25194782]]},
 "ctime": 20.602622698779193,
 "energy": -616.60117566,
 "forces": {"__ndarray__": [[84, 3], "float64", [-0.20193, -0.020561, -0.13429, -0.110875, 0.180341, -0.001899, -0.190335, 0.088905, -0.015851, -0.315823, 0.196848, -0.021831, -0.234375, -0.087718, -0.07348, -0.128906, 0.135441, 0.130324, -0.08804, 0.097308, -0.209475, 0.207546, 0.196182, 0.31112, -0.209225, -0.228294, 0.129377, 0.140914, 0.209233, 0.036923, -0.07772, -0.219311, 0.33621, -0.026448, 0.145267, -0.35143, -0.018188, -0.07037, 0.175154, -0.330193, 0.044293, -0.131045, 0.018598, 0.05986, 0.125536, 0.033345, 0.230836, -0.261081, -0.093273, 0.137357, 0.016599, -0.357579, -0.006667, 0.047527, 0.078365, 0.157803, -0.306302, -0.137362, -0.153961, 0.260787, -0.127651, -0.273483, -0.020129, -0.054956, -0.149139, -0.253982, 0.127185, 0.223758, 0.160496, 0.077243, 0.250872, 0.035292, 0.081471, -0.061273, 0.186949, 0.045756, -0.05533, -0.046462, 0.117391, -0.089483, 0.024747, 0.229556, -0.130096, 0.00324, 0.035916, 0.099294, -0.022524, -0.098184, 0.070567, -0.058233, 0.113125, 0.074858, 0.109327, 0.018045, 0.238283, -0.173457, 0.099916, 0.094533, 0.170147, -0.088872, -0.089936, 0.122735, -0.130497, -0.073534, -0.17526, -0.044388, -0.181089, -0.025029, 0.470628, 0.126118, -0.048821, 0.029794, -0.077607, -0.267067, -0.14951, 0.178711, 0.06386, 0.153394, 0.012608, -0.061016, 0.19056, -0.273527, 0.028256, 0.056108, -0.117455, -0.056056, 0.282194, -0.109629, 0.046885, 0.118488, -0.19776, -0.054145, 0.151914, -0.159876, -0.130539, -0.03389, 0.086108, 0.022318, -0.080388, 0.099196, 0.091099, 0.156012, -0.289539, 0.130985, -0.000528, 0.064204, -0.085847, 0.057473, -0.119428, 0.195342, -0.047936, -0.124367, 0.021416, 0.068098, -0.039663, -0.116634, 0.140247, -0.053803, -0.088581, 0.09226, -0.123946, 0.190408, -0.149552, 0.187345, 0.080583, -0.055565, -0.103714, -0.146069, 0.049462, -0.114776, 0.147115, 0.118067, -0.040483, 0.079235, -0.138319, 0.220589, 0.049566, 0.077365, 0.159612, -0.021282, -0.460779, 0.335577, -0.137492, -0.460514, 0.011228, 0.285639, 0.090635, 0.097807, 0.249118, 0.273191, -0.004376, -0.162858, 0.173201, -0.302644, -0.14204, -0.089755, -0.155695, -0.216282, 0.22024, -0.017869, 0.128916, 0.034277, 0.126815, 0.127661, 0.136692, -0.204717, -0.019261, 0.504827, -0.177139, -0.353292, 0.007594, -0.301371, -0.134989, 0.267877, -0.130949, -0.080914, -0.326474, 0.085252, 0.01795, 0.065339, 0.222438, 0.134251, -0.162911, 0.03844, 0.393707, -0.427945, -0.081172, 0.137159, 0.027061, 0.03373, -0.035768, -0.090786, 0.043309, -0.025282, 0.074505, 0.2987, -0.204433, 0.204286, 0.055433, -0.108264, 0.112921, -0.07042, 0.131556, -0.339749, -0.013779, 0.038668, 0.133208, 0.117662, -0.164589, 0.117128, -0.236772, -0.0309]]},
 "free_energy": -616.70349854,
 "key_value_pairs": {"perms_num": 1},
 "mtime": 25.586837892883914,
 "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", [5.66323, 11.76372, 11.01907, 3.3947, 9.47456, 9.29375, 4.40904, 10.12134, 11.06543, 4.9699, 12.20281, 7.48097, 5.95646, 12.83279, 9.19245, 3.68163, 10.49305, 7.51207, 8.03301, 13.07273, 9.42129, 5.85896, 11.69399, 5.59802, 7.70037, 11.81268, 11.58799, 4.91132, 8.16426, 11.72715, 4.34881, 9.7077, 5.65412, 3.7058, 7.38555, 9.61477, 6.59329, 8.46914, 12.98841, 3.87654, 7.60926, 5.81972, 7.88074, 10.1549, 12.93673, 7.72208, 12.73796, 5.68017, 8.76895, 13.3761, 7.42104, 3.59859, 6.53494, 7.62271, 9.88282, 9.27711, 12.85585, 10.80141, 12.58666, 7.19576, 9.27138, 11.66369, 4.55074, 7.94938, 6.75924, 12.92824, 5.31756, 6.41133, 4.68662, 4.89584, 4.78261, 7.47354, 6.14258, 11.04243, 10.34542, 4.45409, 9.32292, 9.07383, 5.20312, 9.80202, 10.38744, 5.62405, 11.36475, 7.70297, 6.35918, 11.83232, 8.98984, 4.67341, 10.09422, 7.73921, 7.90501, 12.10447, 8.89186, 6.47881, 11.20301, 6.39112, 7.57362, 10.88754, 10.97739, 5.74626, 8.48311, 11.06057, 5.01806, 9.27723, 6.44255, 4.59266, 7.75666, 9.04633, 8.51312, 11.19651, 9.88781, 6.31423, 9.80261, 5.97114, 5.66106, 7.43594, 10.01869, 7.00332, 8.46845, 11.97684, 4.80736, 7.74434, 6.36328, 7.95368, 9.71884, 11.93769, 7.89801, 11.82168, 6.23806, 8.64685, 12.29602, 7.53377, 4.59719, 6.95503, 7.70927, 7.12093, 9.1725, 5.08577, 9.82852, 10.88194, 9.90934, 6.33412, 6.27022, 10.05113, 9.45281, 9.16387, 11.83137, 10.13871, 11.72416, 7.45339, 8.96174, 10.98015, 5.37571, 7.93326, 7.16929, 11.89191, 5.88006, 6.93085, 5.50273, 5.54773, 5.67368, 7.64955, 8.47733, 9.6395, 4.8842, 10.29998, 9.80507, 10.75852, 7.01933, 7.73968, 4.94029, 10.60247, 11.00271, 8.69247, 7.53379, 6.14447, 10.85898, 6.39845, 5.43889, 8.86971, 9.3308, 7.67317, 11.55894, 10.16725, 10.76108, 6.27774, 6.43794, 5.87553, 6.43784, 8.3417, 7.30239, 4.90644, 11.3891, 9.85419, 8.68485, 9.24165, 8.47547, 4.8738, 7.71798, 4.99649, 8.82948, 11.19413, 9.10599, 9.94218, 8.42331, 5.44203, 10.0527, 10.18566, 7.00274, 10.74036, 10.89687, 9.6071, 6.28931, 7.74185, 5.46816, 6.41667, 8.75972, 6.13412, 5.59714, 11.58327, 9.11961, 7.48317, 11.20015, 7.68844, 9.92154, 9.80008, 5.80795, 9.984, 10.48617, 8.41213, 5.54076, 8.43481, 4.96129, 7.60796, 10.83924, 7.25772, 6.2826, 11.33876, 6.98799, 8.7078, 9.78229, 5.3886, 7.5578, 10.47485, 5.80749, 8.74146, 9.9782, 6.12098, 6.3119, 11.52416, 7.7094, 7.49336]]},
 "stress": {"__ndarray__": [[6], "float64", [-0.0006025615325218957, 0.00023433121862216104, 0.0005785941374785039, -0.0002284267509890755, 0.00014097696662632514, 0.0007598974945671607]]},
 "unique_id": "a11992a3fd7557b4127fba8823811dde",
 "user": "mse-gucc"},
"ids": [1],
"nextid": 2}