{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [17.643342023, -0.38962224, -0.124910794, -0.389595095, 16.585728173, 0.05974444, -0.124785803, 0.059728116, 16.198895324]]},
 "ctime": 20.602645513113316,
 "energy": -595.9378051,
 "forces": {"__ndarray__": [[78, 3], "float64", [-0.020942, 0.079925, -0.168978, -0.188021, 0.133416, 0.064959, -0.250572, -0.296089, 0.016892, 0.27007, -0.168343, 0.328039, 0.012385, -0.396791, -0.100035, 0.107681, 0.05431, -0.378557, -0.109082, -0.030401, 0.171686, -0.24239, -0.192978, -0.238264, -0.041463, 0.133141, 0.090011, -0.143356, -0.171028, 0.277328, -0.000867, 0.031205, -0.255697, -0.075197, 0.14066, 0.14461, -0.078915, 0.338978, -0.373954, -0.137494, -0.039182, 0.302847, 0.028882, -0.007453, 0.278872, 0.251552, 0.119004, 0.230524, 0.171766, -0.298177, -0.062189, 0.33393, -0.022667, -0.063315, 0.0835, 0.347106, 0.335841, -0.10439, 0.026126, -0.23657, -0.154596, 0.08185, 0.615187, -0.207561, 0.146332, -0.190085, -0.042085, 0.499598, -0.165486, -0.346152, 0.373908, -0.127172, -0.140257, -0.035586, -0.083647, 0.029543, 0.290516, -0.362696, 0.257215, -0.182381, 0.639215, 0.090278, 0.070454, 0.256271, -0.376996, -0.172332, -0.631771, 0.064993, -0.107554, 0.007891, -0.069297, -0.113932, -0.015877, 0.084673, -0.012912, 0.111934, 0.314535, -0.033105, 0.282663, 0.271939, -0.134353, 0.191919, -0.148609, -0.231699, -0.266963, 0.139159, 0.224573, 0.133886, -0.028305, -0.335288, -0.491722, 0.260162, 0.103523, -0.070669, -0.015247, -0.135849, 0.282581, 0.536931, -0.186162, -0.036883, 0.082533, -0.042122, 0.081007, 0.361479, 0.032447, -0.164631, -0.448083, -0.406954, -0.086628, 0.643309, 0.263186, 0.116213, -0.297351, 0.255219, 0.429241, 0.330864, -0.488874, 0.222387, 0.064538, -0.275935, -0.573629, -0.037031, 0.094345, -0.345793, 0.074568, -0.562544, 0.030739, 0.474102, -0.483023, -0.220169, -0.207833, -0.172887, -0.097062, 0.014474, 0.158815, -0.234784, 0.025357, -0.209776, 0.574449, 0.302476, 0.208718, 0.423786, -0.369424, 0.257166, -0.161098, -0.107319, 0.346651, 0.138679, -0.593667, 0.352316, -0.165866, -0.082623, 0.418756, -0.053514, -0.234303, 0.304701, 0.080947, 0.108278, -0.003049, -0.035232, -0.036653, 0.154033, -0.003969, -0.118984, 0.141019, 0.134555, -0.752424, -0.091099, -0.185078, -0.446171, 0.072436, -0.0257, 0.088842, 0.055004, 0.224886, 0.143926, 0.250197, 0.133222, -0.042731, -0.127067, 0.041945, 0.471377, 0.106057, 0.142574, 0.051683, 0.241451, 0.272897, -0.195596, -0.100397, 0.275862, -0.282413, 0.093978, -0.639529, 0.103382, -0.312483, 0.210268, -0.027356, -0.036521, -0.348391, 0.049878, 0.099858, -0.105251, -0.218047, -0.230056, -0.055417, 0.310051, -0.349984, 0.053858, -0.057146, -0.216702, -0.503436, 0.466644, 0.312758, -0.02496]]},
 "free_energy": -595.9378078,
 "key_value_pairs": {"perms_num": 1},
 "mtime": 25.076353318527936,
 "numbers": {"__ndarray__": [[78], "int32", [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__": [[78, 3], "float64", [5.6203, 11.27407, 10.4468, 3.79722, 9.22236, 8.85665, 5.26986, 11.74047, 7.31671, 6.3586, 11.61926, 5.30752, 7.57993, 11.45133, 11.61113, 3.81416, 6.90529, 8.98797, 10.85371, 12.29323, 7.02876, 8.0883, 6.79893, 12.71403, 5.82594, 6.03065, 4.65189, 7.36318, 7.14651, 3.4303, 11.79368, 11.65842, 8.99008, 7.59943, 4.89458, 11.54464, 12.62111, 7.23614, 10.83853, 11.91154, 8.22778, 4.41711, 8.99893, 3.27447, 7.23366, 12.46893, 6.33554, 5.6243, 13.0569, 6.1856, 8.84256, 11.13567, 3.98787, 7.33611, 6.3642, 10.61209, 9.95792, 4.82612, 8.87122, 8.68877, 5.76395, 9.25075, 9.79472, 5.99722, 10.90434, 7.38163, 6.81289, 11.101, 8.60867, 5.39913, 9.49993, 7.45588, 8.12219, 11.49743, 8.58609, 6.82144, 10.89281, 6.01921, 7.70633, 10.69361, 10.80389, 6.19283, 8.16069, 10.48921, 5.74798, 8.76913, 6.36719, 4.82589, 7.27072, 8.71871, 8.76923, 11.18525, 9.83239, 6.62618, 9.48611, 5.47969, 5.76272, 6.93296, 9.86471, 7.37725, 8.23114, 11.28868, 5.70108, 7.3443, 6.35354, 8.1588, 9.35065, 11.3421, 8.30673, 11.14304, 6.18386, 8.86536, 11.53135, 7.36427, 5.39423, 6.62562, 7.47267, 7.54478, 8.82905, 4.73244, 10.06682, 10.78917, 9.8665, 6.54981, 5.82407, 9.91446, 9.56852, 8.95878, 11.42306, 10.36982, 11.34399, 7.34317, 9.31086, 10.41806, 5.38907, 8.17609, 6.99439, 11.62215, 6.51031, 6.52653, 5.37084, 6.24288, 5.4384, 7.51104, 8.93561, 9.29208, 4.67699, 10.50184, 9.66852, 10.68692, 7.5474, 7.32431, 4.5136, 11.02335, 10.91658, 8.70344, 7.77134, 5.71169, 10.81703, 6.81229, 5.03177, 8.70611, 9.60761, 7.48587, 11.40459, 10.5273, 10.36826, 6.18856, 7.06895, 5.45442, 6.29863, 8.99989, 6.97737, 4.80486, 11.66961, 9.53181, 8.70855, 9.7834, 8.09744, 4.74677, 8.22714, 4.65969, 8.73117, 11.51013, 8.91441, 9.92009, 8.82272, 5.18528, 9.85278, 10.54102, 6.79746, 10.6927, 11.31947, 9.2705, 6.23572, 8.36298, 5.07588, 6.30152, 9.37206, 5.86787, 5.63161, 11.81774, 8.78233, 7.49827, 11.79175, 7.43409, 10.12072, 10.15929, 5.68589, 9.84832, 11.2113, 8.11223, 5.27542, 8.99622, 4.35405, 7.47061, 11.63109, 6.84037, 6.14284, 12.05348, 6.62608, 8.76963, 10.50604, 4.87663, 7.49399, 10.92943, 5.61239, 8.73043, 10.54526, 5.84116, 6.33498, 11.94331, 7.42166, 7.50392]]},
 "stress": {"__ndarray__": [[6], "float64", [-0.0008206773104350119, -0.00043902775191462836, -0.0011440998303200308, 0.00029122881581371285, 3.3697907770643715e-05, -0.0003784414228296796]]},
 "unique_id": "43afff9a25d915105b967f26d2f7810d",
 "user": "mse-gucc"},
"ids": [1],
"nextid": 2}