{"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": 20.635542645609714,
 "energy": -666.09860833,
 "forces": {"__ndarray__": [[96, 3], "float64", [-0.002909, 0.008292, 0.001607, -0.002309, 0.002945, 0.004988, 0.005045, 0.001758, -0.001864, -0.001046, 0.008711, -0.004726, -0.003, -0.00307, -0.000629, -0.003175, 0.000259, -0.002063, -0.002095, -0.000252, 0.005723, -0.004255, 0.002786, -0.002701, -0.002253, -0.006848, 0.005869, -0.006627, -0.002202, 0.003754, -6e-06, -0.003764, -0.006121, -0.002279, -0.002877, 0.002805, -0.005384, 0.00222, -0.00141, 0.002804, 0.000578, -0.004473, 0.003031, -0.001388, -0.000553, -0.000825, 0.003532, 0.003529, 0.001936, 0.003609, -9.9e-05, 0.002226, -0.00261, -0.010044, 0.004113, -0.000107, -0.002434, 0.004495, 0.002332, -0.000728, -0.002869, -0.001595, 0.009073, -0.001691, 0.002534, 0.001041, 0.001164, -0.008263, -0.00546, -0.005209, 0.001086, 0.003153, -0.004148, -0.004049, -0.00011, 0.009594, -0.002745, 0.003606, -0.003382, 0.000308, 0.002353, 0.005775, -0.000534, 0.001994, -0.00466, -0.002212, -0.004545, 0.001666, -0.001441, 0.004745, 0.008473, 0.003751, 0.005423, -0.002075, -0.004412, -0.000601, 0.000351, 0.002548, -0.004116, 0.008932, 0.001152, -0.00281, 0.001457, 0.005218, 0.000769, 0.000904, 0.002145, -0.004701, 0.003409, -0.001202, -0.000483, 0.000621, 0.00394, 0.001357, 0.001529, -0.011273, -0.003657, -0.000627, -0.000624, -0.002429, 0.004443, 0.002813, -0.007953, 0.005558, -0.007015, 0.000691, -0.004867, 0.002985, 0.000277, 0.005986, 0.006483, 0.003235, -0.001683, 0.007556, 0.001243, 0.005438, -0.003543, 0.002199, -0.002006, 0.003858, -0.002757, 0.006778, 0.002367, 0.000391, -0.003437, -0.006482, -0.000189, 0.004652, -0.000665, 0.002206, -0.001942, -4.7e-05, -0.001203, 0.003486, 0.004244, 0.004162, 0.002048, -0.000309, 0.011588, 0.00215, -0.00691, -0.004977, 0.003114, 0.005101, -0.003715, -0.004819, 0.000961, 0.006553, -0.00365, -0.004383, -0.007246, 0.003647, 7.1e-05, 0.002279, 0.001618, 0.001738, 0.00301, -0.006371, 0.00065, 0.006177, -0.003641, 0.003096, 0.005617, -0.003967, -0.001524, 0.003186, 0.00531, -0.004501, 0.010548, -0.004383, -0.011887, -0.000175, -0.00102, -0.002343, -0.000181, 0.00287, 0.003329, -0.000918, 0.001207, -0.003718, -0.003727, 0.001366, 0.000723, -0.005631, -0.008485, -0.008075, -0.005604, -0.004103, -0.006767, 0.001462, -0.00088, -0.001855, 0.000122, -0.003556, 0.004931, -0.003546, -0.000538, -0.003426, -0.006345, -0.009339, 0.011856, -0.008031, 0.002553, -0.002526, -0.005578, 0.007914, 0.001963, 0.002884, 0.006748, 0.000186, -0.003695, -0.005962, 0.002921, -0.003525, 0.002707, -0.006076, 0.00303, -0.005373, 0.000561, 0.002606, -0.006241, 0.003929, -0.004628, -0.002844, 0.00516, -0.00204, -0.004175, -0.012194, 0.00386, 0.005652, -0.007018, 0.002034, -0.004305, 0.003915, -0.011396, 0.001644, 0.000625, -0.00747, 0.006076, 0.007879, 0.001505, 0.00434, -0.003693, -0.003145, 0.009953, 0.005594, 0.00117, 0.003938, 0.006129, 0.001676, -0.000597, 0.000998, 0.006029, -0.003516, -0.004814, 0.009176, -0.006023, -0.006798, -0.000276, -0.00686, 0.011189, 0.001991, -0.004125, 0.007041, 0.003369, 0.000808, -0.002524, 0.004645]]},
 "free_energy": -666.09860833,
 "key_value_pairs": {"perms_num": 12},
 "mtime": 25.17050961210411,
 "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", [6.68144, 13.69321, 9.14939, 7.48106, 14.04671, 11.09966, 5.47829, 11.77367, 9.18114, 9.4693, 14.9381, 10.83838, 7.73627, 13.35842, 7.25454, 6.54975, 10.28784, 13.4568, 5.20318, 9.07196, 10.62395, 10.43627, 14.09384, 12.70456, 6.02049, 8.33539, 12.60422, 8.24556, 9.98877, 14.72337, 5.78069, 9.15199, 7.60474, 9.60551, 11.79458, 14.57132, 9.64514, 14.30686, 7.4121, 10.83177, 14.75272, 9.20318, 7.26123, 6.62987, 12.25377, 11.18673, 13.05472, 6.32299, 9.79379, 8.43609, 14.63126, 7.22297, 7.96985, 6.31932, 12.5379, 12.07112, 13.68132, 8.57685, 9.32156, 5.36779, 8.92699, 6.73083, 13.67923, 7.6431, 6.35368, 7.74271, 10.53298, 8.33028, 5.27564, 14.2668, 12.26042, 10.79976, 11.82918, 10.18239, 5.42808, 14.20687, 10.99306, 12.59188, 10.49714, 5.72466, 12.39353, 13.75913, 11.68281, 7.29808, 9.64845, 5.70355, 7.3939, 11.34032, 6.80943, 6.54144, 14.86175, 11.02124, 9.16298, 13.89271, 8.88452, 12.74602, 10.60127, 5.1522, 9.37301, 14.53789, 7.98717, 10.85099, 13.08534, 6.24972, 10.81845, 14.62635, 8.85555, 8.90116, 8.19342, 12.18625, 11.70559, 6.65854, 10.69277, 10.60035, 7.35564, 11.04506, 11.69243, 7.40284, 12.88482, 9.32613, 8.12199, 13.26168, 10.66183, 6.54797, 11.53012, 9.35419, 9.57842, 13.85991, 10.66284, 8.28244, 12.78388, 8.02307, 9.26203, 12.26826, 12.51419, 7.37357, 10.00842, 12.77688, 7.11512, 10.70692, 8.21543, 6.3036, 9.22067, 10.63563, 10.26869, 13.2677, 11.98162, 8.1336, 11.34683, 7.61933, 6.88429, 8.70636, 12.0373, 8.63629, 9.98981, 13.69742, 6.802, 9.24667, 8.03029, 9.59309, 11.27104, 13.59209, 9.73085, 13.36973, 7.97771, 10.41391, 13.74097, 9.34739, 6.8883, 8.59751, 9.3966, 9.11752, 10.65138, 6.87592, 11.5645, 12.52665, 11.78569, 7.87411, 7.49974, 11.95904, 10.95487, 10.6959, 13.25982, 11.60426, 12.82904, 9.39566, 10.81677, 12.48459, 7.20132, 9.60346, 8.75154, 13.59039, 7.82408, 8.40677, 7.12737, 7.79252, 7.60524, 9.40027, 10.36684, 11.12415, 6.74042, 12.1111, 11.54464, 12.80157, 8.93595, 9.23769, 6.40854, 12.19753, 12.4017, 10.60829, 9.15716, 7.43738, 12.87116, 8.40565, 7.16184, 10.59723, 10.89166, 9.36195, 13.1236, 11.91929, 12.26719, 8.21788, 8.27958, 7.20597, 8.03883, 10.41291, 8.70215, 6.30149, 13.43263, 11.55145, 10.65546, 11.33531, 10.00772, 6.40735, 9.62851, 6.60821, 10.60125, 13.28984, 10.78651, 12.02506, 10.27211, 6.7255, 11.96821, 11.85748, 8.64188, 12.38003, 13.0256, 11.26652, 8.02037, 9.73393, 6.63972, 7.96111, 10.82085, 7.50662, 7.22209, 13.80247, 10.79321, 9.33917, 13.17813, 9.22774, 11.97741, 11.56438, 7.47483, 11.78436, 12.38641, 10.00091, 7.48514, 10.40275, 6.24487, 9.36212, 12.63783, 8.9595, 8.29394, 13.54602, 8.42315, 10.67407, 11.69359, 7.03799, 9.39812, 12.52282, 7.19165, 10.6457, 11.81318, 7.8091, 8.30606, 13.68166, 9.22305, 9.33879]]},
 "stress": {"__ndarray__": [[6], "float64", [0.000128687435157461, 9.445899911111724e-05, 0.0001525549660548386, 9.231191997181339e-06, 1.2227116377605303e-05, 6.772037401583335e-06]]},
 "unique_id": "3424dc103ceb218a3e4c2ac5aded181c",
 "user": "mse-gucc"},
"ids": [1],
"nextid": 2}