{"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": 20.636162513771126,
 "energy": -611.33692792,
 "forces": {"__ndarray__": [[84, 3], "float64", [0.011774, -0.001915, 0.002089, 0.007588, -0.000512, -0.004937, 0.005438, -0.001158, 0.001919, 0.003331, -0.000841, -0.000302, -0.010386, -0.00046, -0.006191, -0.000968, -0.008149, 0.00173, -0.009094, -0.002831, 0.003347, 0.009034, 0.001248, 0.000163, -0.002033, 0.002072, 0.000843, -0.009036, -0.001738, 0.002238, 0.009396, 0.010873, 0.006192, -0.009891, -0.002579, 0.007574, -0.009396, -0.010873, -0.006192, 0.009891, 0.002579, -0.007574, 0.009036, 0.001738, -0.002238, -0.009034, -0.001248, -0.000163, 0.002033, -0.002072, -0.000843, 0.009094, 0.002831, -0.003347, 0.000968, 0.008149, -0.00173, 0.010386, 0.00046, 0.006191, -0.003331, 0.000841, 0.000302, -0.005438, 0.001158, -0.001919, -0.011774, 0.001915, -0.002089, -0.007588, 0.000512, 0.004937, 0.003123, -0.003453, -0.011309, 0.00422, -0.003761, -0.000912, 0.003495, -0.001199, -0.007689, -0.006008, -0.000885, 0.006443, 0.006782, 0.000644, -0.000407, -0.008761, -0.001804, 0.002618, 0.007437, 0.004863, 0.010186, 0.004721, -0.001272, 0.001355, -0.00357, -0.018595, -0.007675, -0.010533, -0.003285, -0.001229, 0.005453, -0.003772, -0.005505, 0.000904, -0.004521, 0.001787, 0.007641, -0.000582, -0.004892, 0.011247, 0.004404, -0.002535, -0.004644, -0.001305, -0.001376, -0.003333, 0.003485, 0.006424, 0.008974, -0.004183, -0.008188, -0.010592, -0.008481, 0.012539, 0.005047, 0.003185, -0.000511, 0.000659, -0.002607, -0.010047, 0.006089, -0.001759, -0.008624, -5.8e-05, 0.00596, 0.000712, -0.002867, 0.010755, -0.006608, 0.006386, 0.004023, 0.000761, 0.002526, -0.003488, -0.005946, 0.003049, -0.000769, 0.004765, -0.004866, 0.000873, -0.002064, 0.004458, 0.010817, 0.006013, 0.002754, -0.000539, 0.015746, -0.003227, -0.005119, -0.008938, -0.004458, -0.010817, -0.006013, -0.002754, 0.000539, -0.015746, -0.002526, 0.003488, 0.005946, 0.003227, 0.005119, 0.008938, 0.004866, -0.000873, 0.002064, -0.003049, 0.000769, -0.004765, 5.8e-05, -0.00596, -0.000712, -0.006386, -0.004023, -0.000761, 0.002867, -0.010755, 0.006608, 0.010592, 0.008481, -0.012539, -0.006089, 0.001759, 0.008624, 0.003333, -0.003485, -0.006424, -0.000659, 0.002607, 0.010047, -0.008974, 0.004183, 0.008188, -0.005047, -0.003185, 0.000511, -0.011247, -0.004404, 0.002535, 0.004644, 0.001305, 0.001376, -0.007641, 0.000582, 0.004892, 0.00357, 0.018595, 0.007675, -0.000904, 0.004521, -0.001787, -0.005453, 0.003772, 0.005505, -0.004721, 0.001272, -0.001355, 0.010533, 0.003285, 0.001229, -0.007437, -0.004863, -0.010186, -0.003495, 0.001199, 0.007689, 0.008761, 0.001804, -0.002618, -0.006782, -0.000644, 0.000407, 0.006008, 0.000885, -0.006443, -0.003123, 0.003453, 0.011309, -0.00422, 0.003761, 0.000912]]},
 "free_energy": -611.49869669,
 "key_value_pairs": {"perms_num": 6},
 "mtime": 25.336416678950233,
 "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", [7.40626, 13.29882, 12.53618, 5.23116, 10.91981, 10.63326, 6.10029, 11.52788, 12.66717, 7.89159, 13.72266, 7.61006, 10.32924, 14.23775, 12.53606, 7.13012, 11.91093, 6.42548, 9.44979, 11.61861, 14.65237, 8.74394, 10.87619, 5.33619, 7.25734, 6.94935, 12.67924, 12.30265, 14.32225, 9.17957, 7.25168, 8.02067, 6.39409, 6.72853, 6.47579, 9.00829, 12.74832, 11.97933, 13.60591, 13.27147, 13.52421, 10.99171, 7.69735, 5.67775, 10.82043, 11.25606, 9.12381, 14.66381, 12.74266, 13.05065, 7.32076, 10.55021, 8.38139, 5.34763, 12.86988, 8.08907, 13.57452, 9.67076, 5.76225, 7.46394, 12.10841, 6.27734, 12.38994, 13.89971, 8.47212, 7.33283, 12.59374, 6.70118, 7.46382, 14.76884, 9.08019, 9.36674, 7.9069, 12.4755, 11.96554, 6.32686, 10.7689, 10.63067, 6.93779, 11.25309, 12.00566, 7.69224, 12.54933, 9.41971, 8.28446, 13.01205, 10.59106, 6.9014, 11.40675, 9.40441, 9.61917, 13.4738, 10.5866, 8.3032, 12.79261, 8.0441, 9.27081, 12.27342, 12.55928, 7.60844, 10.00088, 12.54118, 7.0963, 10.6966, 8.19888, 6.64318, 9.27794, 10.58502, 10.25247, 13.26589, 11.96963, 7.84012, 11.54805, 7.18641, 7.25286, 8.87381, 11.76665, 8.76293, 9.98576, 13.32651, 7.04182, 9.30167, 8.18286, 9.58887, 11.25265, 13.59557, 9.78275, 12.949, 8.21049, 10.36704, 13.41705, 9.40879, 6.83828, 8.59442, 9.38863, 8.94693, 10.74677, 6.42972, 11.55729, 12.56627, 11.8174, 7.87625, 7.52794, 11.96874, 10.97602, 10.72496, 13.28876, 11.88029, 13.3176, 9.34482, 10.72778, 12.26632, 7.45278, 9.60741, 8.8532, 13.30259, 7.886, 8.45966, 7.21672, 7.49781, 7.22267, 9.32917, 10.39259, 11.1468, 6.69741, 12.114, 11.54034, 12.78328, 9.02398, 9.27504, 6.71124, 12.50219, 12.77733, 10.67083, 9.27222, 7.73368, 12.54722, 8.11971, 6.6824, 10.65518, 11.05307, 9.25323, 13.57028, 12.12375, 12.47206, 8.03126, 8.44271, 7.43373, 8.1826, 10.41113, 8.74735, 6.40443, 13.16172, 11.40558, 10.61137, 11.23707, 10.01424, 6.67349, 9.63296, 6.58295, 10.59121, 12.95818, 10.69833, 11.81714, 10.21725, 7.051, 11.78951, 12.15988, 8.45195, 12.81359, 12.74714, 11.12619, 8.23335, 9.74753, 6.73411, 8.03037, 10.72919, 7.72658, 7.44072, 13.35682, 10.72206, 9.41498, 12.9037, 9.3034, 11.80112, 11.6968, 7.20739, 11.9559, 12.39156, 9.99912, 7.45882, 10.38083, 6.5262, 9.4134, 13.06221, 8.74691, 7.99434, 13.0986, 8.59325, 10.59559, 11.71554, 6.98795, 9.40894, 12.30776, 7.45067, 10.58029, 12.0931, 7.5245, 8.03446, 13.67314, 9.2311, 9.36933]]},
 "stress": {"__ndarray__": [[6], "float64", [0.00011559274901135794, 0.00010000145921490157, 0.00012614714094322656, 2.1420859320031346e-05, 3.170686635948695e-05, -3.905312260065155e-05]]},
 "unique_id": "432352b9dd50d91afa096d8541fc3a93",
 "user": "mse-gucc"},
"ids": [1],
"nextid": 2}