{"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": 20.636161747904385,
 "energy": -610.61129531,
 "forces": {"__ndarray__": [[84, 3], "float64", [0.000502, -0.004402, -0.014494, -0.005654, 0.010426, -0.003856, 0.009594, -0.009598, 0.007447, -0.007466, -0.012625, -0.008533, -0.006861, -0.002626, 0.009905, 0.036739, 0.005101, 0.002663, 0.010939, -0.010523, 0.026123, -0.014423, -0.00088, -0.020468, 0.008182, 0.012857, -0.019364, -0.008683, -0.015891, -0.020422, -0.012494, -0.034004, 0.012949, 0.005818, 0.00178, -0.004606, -0.00463, -0.017322, -0.002501, 0.014904, 0.015059, 0.000855, 0.007398, 0.006703, -0.007582, -0.000337, -0.010585, 0.00619, -0.01831, 0.001097, 0.016841, 0.012197, 0.011565, -0.002291, -0.002653, 0.000464, 0.009142, 0.003563, 0.004671, 0.016341, -0.004252, -0.004463, -0.015971, -0.010609, 0.010068, -0.008768, -0.007181, 0.011974, 0.001841, 0.00753, -0.00029, 0.005143, 0.002742, -0.000939, -0.002596, 0.00666, -0.017108, -0.006334, 0.006336, 0.005595, -0.00184, -0.007557, -0.007663, 0.019366, 0.0259, 0.016745, -0.014427, -0.001526, -0.007877, -0.005086, -0.01132, 0.01857, -0.008153, 0.02197, 0.018, 0.016733, 0.000645, 0.005947, 0.003468, -0.010863, -0.009771, -0.001373, 0.022643, 0.009787, 0.013998, 0.011866, -0.015285, -0.027553, 0.004448, -0.011655, -0.01634, 0.033005, -0.040006, -0.000166, 0.009067, -0.013473, 0.025936, 0.009083, 0.017371, 0.00024, 0.005082, 0.019762, -0.0208, 0.007754, -0.001741, -0.013002, -0.008614, 0.029973, 0.007894, 0.011986, 0.027623, -0.014891, 0.017578, 0.01377, 0.014328, -0.022496, -0.007143, -0.028264, -0.012077, -0.013488, -0.001752, 0.01358, -0.00209, 0.01085, -0.007216, 0.026721, -0.008705, -0.020513, -0.007573, 0.000247, -0.007692, -0.005638, 0.026761, -0.042835, -0.036548, 0.008161, -0.011152, -0.010366, -0.008219, -0.007806, 0.007603, 0.012766, -0.001614, -0.005327, 0.01909, 0.000745, -0.018176, 0.02204, 0.020074, -0.013166, -0.021645, -0.01482, 0.008162, 0.00373, -0.015779, 0.016993, -0.009424, 0.017417, 0.0005, 0.005948, 0.026319, -0.001675, -0.022935, -0.021057, 0.022809, 0.024578, 0.002752, 0.009664, -0.009688, -0.013785, 0.001379, -0.004043, -0.003044, -0.024192, 0.007391, -0.012556, -0.006246, 0.010165, -0.032166, 0.010187, -0.012776, 0.002085, 0.01917, 0.002247, -0.013997, -0.008677, -0.003609, 0.045352, 0.00645, 0.005082, 0.005744, -0.025602, -0.001916, -0.007537, -0.009573, 0.003566, 0.002735, 0.005191, 0.005621, -4.1e-05, 0.011652, -0.00407, 0.004762, -0.010434, -0.00075, -0.029091, -0.008004, -0.009289, -0.010609, 0.02431, -0.013357, 0.021223, 0.005596, -0.004982, 0.000762, -0.009974, 0.025647, -0.004342, 0.006758, -0.013864, 0.00887, -0.005197, 0.010675, -0.004819, 0.00194, 0.004435, -0.00981, 0.01656, 0.014091, -0.016266, 0.001258, 0.000215]]},
 "free_energy": -610.78287045,
 "key_value_pairs": {"perms_num": 1},
 "mtime": 25.159211246297637,
 "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", [7.22767, 13.3561, 12.42698, 5.20359, 10.92038, 10.65953, 6.07886, 11.50635, 12.68288, 7.73554, 13.63749, 7.54292, 9.1405, 13.18918, 13.66036, 5.94361, 10.92587, 7.48717, 10.49904, 14.78898, 9.23026, 8.58453, 10.89626, 5.33539, 7.24611, 6.85821, 12.50544, 11.39056, 11.01744, 14.55069, 11.14873, 13.20533, 6.4307, 9.38664, 8.4456, 14.65244, 6.65977, 6.43586, 9.33585, 13.10882, 13.73397, 10.84011, 7.7161, 6.47743, 7.31416, 14.487, 11.92268, 11.00387, 11.72552, 9.9959, 5.44944, 10.31124, 5.72333, 12.45411, 12.82156, 8.07763, 13.57425, 9.73241, 5.65542, 7.5715, 11.18243, 6.91509, 6.34044, 14.75956, 11.08013, 8.99872, 13.20689, 6.42506, 10.78252, 14.70859, 8.80571, 9.16394, 7.83497, 12.54469, 11.99507, 6.30069, 10.78785, 10.63119, 6.91845, 11.26555, 12.01168, 7.66889, 12.54402, 9.42078, 8.28955, 12.99439, 10.61787, 6.85227, 11.45958, 9.41186, 9.60427, 13.40552, 10.6097, 8.29409, 12.79217, 8.03809, 9.19481, 12.48555, 12.8094, 7.58016, 10.00365, 12.53695, 6.89428, 10.75732, 8.05684, 6.62054, 9.28677, 10.58149, 10.24722, 12.99045, 11.81192, 8.06455, 11.44463, 7.40584, 7.2361, 8.88939, 11.80324, 8.78868, 10.02913, 13.28494, 7.11916, 9.27399, 8.1969, 9.58436, 11.12926, 13.31021, 9.7552, 13.04621, 8.14289, 10.38743, 13.68123, 9.35036, 6.84806, 8.59019, 9.41657, 8.9277, 10.76807, 6.40053, 11.55769, 12.57084, 11.80343, 7.92146, 7.55345, 11.94344, 11.04673, 10.74123, 13.52036, 11.74991, 12.98989, 9.36929, 10.80753, 12.48089, 7.22637, 9.58591, 8.74831, 13.58435, 8.0495, 8.57397, 7.46179, 7.46966, 7.18731, 9.36556, 10.35381, 11.18224, 6.66564, 11.95529, 11.40189, 12.51392, 9.0383, 9.26269, 6.70677, 12.52706, 12.8165, 10.63801, 9.2684, 7.67737, 12.60216, 8.30797, 6.96617, 10.58691, 10.9825, 9.25078, 13.3323, 11.95729, 12.28544, 8.2272, 8.25398, 7.16425, 7.98679, 10.32973, 8.84254, 6.68769, 13.49876, 11.56345, 10.67559, 11.28538, 10.01686, 6.47965, 9.60699, 6.57061, 10.57878, 12.91818, 10.72376, 11.80014, 10.25709, 6.737, 11.96223, 12.11835, 8.46635, 12.78306, 12.78508, 11.13048, 8.20339, 9.74679, 6.66863, 8.00422, 10.8125, 7.51673, 7.19074, 13.7484, 10.7914, 9.32717, 12.93122, 9.30263, 11.77919, 11.5788, 7.40828, 11.85602, 12.40687, 10.01667, 7.48678, 10.37647, 6.57143, 9.38274, 12.77165, 8.83725, 8.19733, 13.17168, 8.61273, 10.63493, 11.68051, 7.01501, 9.39125, 12.46841, 7.25761, 10.65334, 11.95937, 7.72696, 8.18869, 13.69814, 9.20677, 9.36497]]},
 "stress": {"__ndarray__": [[6], "float64", [0.00016309063345932955, 0.00011717809232933227, 0.0001317520161382697, -1.191504092131114e-05, -5.161103896192866e-05, -3.1145130538157455e-06]]},
 "unique_id": "3cb2a8b50f1b711b74b1f3968fa87d45",
 "user": "mse-gucc"},
"ids": [1],
"nextid": 2}