{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [18.286686699, -0.176329616, 0.081645709, -0.176011083, 16.835504502, 0.30040877, 0.081233098, 0.300093738, 16.673916369]]},
 "ctime": 20.60264713354242,
 "energy": -594.68349328,
 "forces": {"__ndarray__": [[78, 3], "float64", [-0.182823, 0.169925, 0.108433, 0.243205, 0.008492, -0.102232, -0.120978, -0.318349, -0.08819, -0.178262, -0.070533, -0.079398, -0.069516, 0.161914, -0.213464, -0.554808, -0.213238, -0.411855, -0.141577, -0.095698, -0.00377, 0.122892, -0.172861, -0.023382, -0.048344, 0.311492, 0.025113, -0.122892, 0.172861, 0.023382, 0.048344, -0.311492, -0.025113, 0.141577, 0.095698, 0.00377, 0.554808, 0.213238, 0.411855, 0.069516, -0.161914, 0.213464, 0.178262, 0.070533, 0.079398, 0.120978, 0.318349, 0.08819, 0.182823, -0.169925, -0.108433, -0.243205, -0.008492, 0.102232, 0.036252, 0.454943, 0.228285, -0.122831, -0.113003, -0.020832, -0.029054, 0.355869, 0.031725, 0.214566, 0.077196, -0.249503, 0.100721, 0.396251, 0.113026, -0.391057, -0.375891, 0.08207, 0.319825, -0.224111, 0.014559, -0.240663, 0.01342, 0.241316, -0.298591, 0.213366, 0.004521, 0.212144, -0.122972, 0.169371, 0.499174, 0.106429, -0.061356, -0.364535, -0.074555, -0.092206, -0.001169, 0.117261, 0.559388, -0.197752, 0.30709, -0.15916, 0.005694, -0.013829, 0.015702, 0.228225, -0.129288, 0.013758, -0.151038, -0.191247, -0.19891, 0.007933, 0.300107, -0.282987, 0.027051, 0.208658, 0.024983, -0.08601, -0.059096, -0.283218, -0.004848, 0.048325, -0.024515, -0.176093, -0.113237, 0.121453, 0.028381, -0.318206, 0.076028, -0.358653, -0.050497, -0.240448, 0.483274, 0.064374, 0.185989, 0.008313, 0.479742, -0.180036, 0.25738, -0.342017, 0.106065, 0.01635, -0.09123, 0.21493, 0.230667, -0.040976, -0.029607, -0.154116, 0.095132, 0.018241, -0.01635, 0.09123, -0.21493, -0.230667, 0.040976, 0.029607, -0.483274, -0.064374, -0.185989, 0.154116, -0.095132, -0.018241, -0.25738, 0.342017, -0.106065, -0.008313, -0.479742, 0.180036, 0.176093, 0.113237, -0.121453, 0.358653, 0.050497, 0.240448, -0.028381, 0.318206, -0.076028, -0.007933, -0.300107, 0.282987, 0.004848, -0.048325, 0.024515, -0.228225, 0.129288, -0.013758, 0.08601, 0.059096, 0.283218, 0.151038, 0.191247, 0.19891, -0.027051, -0.208658, -0.024983, 0.197752, -0.30709, 0.15916, -0.005694, 0.013829, -0.015702, 0.001169, -0.117261, -0.559388, 0.298591, -0.213366, -0.004521, 0.364535, 0.074555, 0.092206, -0.499174, -0.106429, 0.061356, 0.240663, -0.01342, -0.241316, -0.212144, 0.122972, -0.169371, -0.319825, 0.224111, -0.014559, 0.029054, -0.355869, -0.031725, 0.391057, 0.375891, -0.08207, -0.100721, -0.396251, -0.113026, -0.214566, -0.077196, 0.249503, -0.036252, -0.454943, -0.228285, 0.122831, 0.113003, 0.020832]]},
 "free_energy": -595.00268355,
 "key_value_pairs": {"perms_num": 2},
 "mtime": 25.58503488724789,
 "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", [6.53693, 11.88934, 10.79635, 4.42824, 9.88894, 9.18069, 4.32915, 7.6743, 9.21989, 6.66103, 10.44289, 4.75333, 7.13852, 8.87958, 13.06972, 11.49705, 12.15236, 10.93129, 11.81272, 12.46421, 7.57797, 8.38732, 7.06443, 13.2229, 6.42965, 6.59182, 4.83841, 9.80459, 9.89484, 3.83307, 11.76226, 10.36745, 12.21756, 6.37919, 4.49506, 9.478, 6.69485, 4.80691, 6.12468, 11.05339, 8.07969, 3.98625, 11.53088, 6.51638, 12.30264, 13.86276, 9.28497, 7.83608, 11.65498, 5.06992, 6.25962, 13.76367, 7.07033, 7.87528, 7.10468, 11.09728, 10.27825, 5.4576, 9.49444, 9.01306, 6.34129, 9.82684, 10.19414, 6.97465, 11.08736, 7.72866, 7.53619, 11.55964, 8.90806, 6.01911, 10.03448, 7.72185, 8.91923, 11.91374, 8.94113, 7.74665, 11.04559, 6.5184, 8.45687, 10.90916, 10.96767, 6.6197, 8.74424, 10.96747, 6.2007, 9.24852, 6.56385, 5.39202, 7.91877, 9.08962, 9.46676, 11.55343, 10.21975, 7.17948, 9.96801, 5.60881, 6.18566, 7.54592, 10.32598, 7.62667, 8.75197, 12.08514, 6.17136, 7.86196, 6.63814, 8.67098, 9.82307, 11.80389, 9.10209, 11.36229, 6.57863, 9.6932, 11.89588, 7.77839, 5.95732, 7.21073, 7.89238, 8.27857, 9.06602, 5.14493, 10.93921, 11.31009, 10.43483, 6.93885, 6.38683, 10.43504, 9.97196, 9.24868, 11.77772, 11.18268, 11.56703, 7.7886, 10.08502, 10.63389, 5.83617, 8.49199, 7.41939, 12.18053, 6.9793, 6.95008, 5.72771, 6.62838, 6.023, 7.96267, 9.69992, 9.53988, 4.87544, 11.21261, 10.00919, 11.32827, 8.21995, 7.71058, 5.27825, 11.56353, 10.93627, 9.0933, 8.10689, 6.32538, 11.2198, 7.00922, 5.39224, 9.26737, 9.91334, 7.89325, 11.91104, 11.25306, 10.57244, 6.62093, 7.2527, 5.64918, 6.62114, 9.52093, 7.1362, 5.25208, 12.23459, 9.74854, 9.16359, 10.56524, 8.2073, 4.97083, 8.49871, 5.06338, 9.27758, 12.02055, 9.09731, 10.41783, 9.08982, 5.59697, 10.47734, 11.01243, 6.99125, 11.44716, 12.00624, 9.41335, 6.72999, 8.72514, 5.40584, 6.83622, 9.73504, 6.05011, 6.0883, 12.79989, 9.0405, 7.96635, 11.99121, 7.71075, 10.49212, 10.44526, 5.91368, 10.53757, 11.57221, 8.21503, 6.0885, 9.27268, 5.04553, 8.11484, 11.85062, 7.13243, 6.86183, 12.1728, 6.92479, 9.33412, 10.65572, 5.39963, 8.14791, 11.21726, 5.87191, 9.32731, 11.08723, 5.86199, 6.77772, 12.73431, 7.46483, 8.04291]]},
 "stress": {"__ndarray__": [[6], "float64", [-0.0003111891619982875, -0.0009253973505490813, 1.1671622065401693e-05, -0.0001486415398329098, -0.00036456654804284107, 0.00047337477663436395]]},
 "unique_id": "73466eb5f748bec7bc06efcbc3fe114f",
 "user": "mse-gucc"},
"ids": [1],
"nextid": 2}