{"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": 20.63555529593412,
 "energy": -652.43477611,
 "forces": {"__ndarray__": [[96, 3], "float64", [0.014463, 0.004889, -0.013332, 0.00317, -0.020716, -0.004982, 0.011552, -0.008702, 0.013557, 0.011621, -0.009985, 0.004752, -0.012051, 0.001769, -0.004533, -0.003537, 0.011842, -0.002331, 0.001432, -0.013706, -0.006557, 0.013123, -0.000114, -0.006798, -0.01139, 0.001693, 0.009475, 0.001524, -0.006343, -0.002089, 0.005873, -0.000436, -0.006941, 0.005164, 0.005972, 0.018128, 0.001207, 0.007482, -0.010826, 0.006623, -1.7e-05, 0.002264, -0.009257, -0.012305, -0.003374, 0.00472, -0.004184, -0.040235, 0.032514, 0.022435, 0.01729, -0.004558, -0.035946, 0.013751, -0.00472, 0.004184, 0.040235, 0.004558, 0.035946, -0.013751, -0.032514, -0.022435, -0.01729, -0.005164, -0.005972, -0.018128, 0.009257, 0.012305, 0.003374, -0.001524, 0.006343, 0.002089, -0.006623, 1.7e-05, -0.002264, -0.005873, 0.000436, 0.006941, -0.001207, -0.007482, 0.010826, 0.003537, -0.011842, 0.002331, 0.01139, -0.001693, -0.009475, -0.013123, 0.000114, 0.006798, 0.012051, -0.001769, 0.004533, -0.001432, 0.013706, 0.006557, -0.011621, 0.009985, -0.004752, -0.014463, -0.004889, 0.013332, -0.011552, 0.008702, -0.013557, -0.00317, 0.020716, 0.004982, 0.003616, 0.00269, -0.004713, 0.007208, -0.002153, 0.002302, -0.002092, -0.015514, -0.003802, -0.001402, -0.004795, -0.001162, 0.004052, -0.003729, 0.004903, 0.005688, 0.003637, -0.009105, -6.3e-05, 0.02088, 0.01484, 0.000404, 0.006506, 0.021394, -0.02543, -0.001479, -0.002214, -0.007127, -0.00821, 0.016679, -0.009288, 0.006176, -0.022341, -0.00071, 0.021817, -0.009543, -0.005758, -0.000598, 0.009655, -0.006798, 0.009804, 0.001292, -0.002532, -0.002982, 0.0041, 0.007506, -0.008481, 0.022179, -0.007045, -0.022151, -0.009479, 0.000253, 0.013192, 0.009294, -0.013594, 0.00594, -0.017178, 0.013287, 0.008683, -0.01305, -0.018903, -0.005532, 0.012426, -0.007403, -0.005596, -0.007703, 0.003245, 0.009117, -0.00571, -0.00217, 0.003846, 0.009149, 3.8e-05, 0.006793, -0.007664, -0.007619, -0.012659, 0.010809, -0.005785, 0.007961, 0.00648, -0.010227, 0.003784, -0.008787, 0.012111, 0.012574, 0.001869, -0.00154, -0.000421, -0.002675, 0.010227, -0.003784, 0.008787, -0.012111, -0.012574, -0.001869, -3.8e-05, -0.006793, 0.007664, 0.00154, 0.000421, 0.002675, 0.005785, -0.007961, -0.00648, 0.007619, 0.012659, -0.010809, 0.007403, 0.005596, 0.007703, 0.00217, -0.003846, -0.009149, -0.003245, -0.009117, 0.00571, -0.000253, -0.013192, -0.009294, 0.018903, 0.005532, -0.012426, -0.007506, 0.008481, -0.022179, -0.013287, -0.008683, 0.01305, 0.007045, 0.022151, 0.009479, 0.013594, -0.00594, 0.017178, 0.006798, -0.009804, -0.001292, 0.002532, 0.002982, -0.0041, 0.005758, 0.000598, -0.009655, 0.02543, 0.001479, 0.002214, 0.00071, -0.021817, 0.009543, 0.009288, -0.006176, 0.022341, -0.000404, -0.006506, -0.021394, 0.007127, 0.00821, -0.016679, 6.3e-05, -0.02088, -0.01484, 0.002092, 0.015514, 0.003802, -0.005688, -0.003637, 0.009105, -0.004052, 0.003729, -0.004903, 0.001402, 0.004795, 0.001162, -0.003616, -0.00269, 0.004713, -0.007208, 0.002153, -0.002302]]},
 "free_energy": -652.43477611,
 "key_value_pairs": {"perms_num": 6},
 "mtime": 25.583377866301735,
 "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", [6.34864, 11.90037, 12.21986, 7.36309, 13.80823, 10.64909, 5.76167, 11.9373, 9.61281, 9.48266, 14.80994, 11.00772, 7.6037, 13.63417, 7.45152, 8.85901, 13.37894, 13.57017, 6.50973, 9.9107, 13.49782, 5.95672, 11.12836, 7.39364, 5.13029, 9.09171, 10.95972, 8.37767, 9.81659, 14.67448, 5.99006, 8.92037, 7.30412, 9.6997, 11.57891, 14.71917, 9.82808, 14.16954, 7.27486, 10.72242, 14.82714, 9.17826, 5.62382, 7.77144, 9.14876, 8.54827, 11.07602, 5.60573, 11.96179, 13.54618, 12.47856, 7.21985, 7.02616, 12.4502, 11.45173, 8.92398, 14.39427, 12.78015, 12.97384, 7.5498, 8.03821, 6.45382, 7.52144, 10.3003, 8.42109, 5.28083, 14.37618, 12.22856, 10.85124, 11.62233, 10.18341, 5.32552, 9.27758, 5.17286, 10.82174, 14.00994, 11.07963, 12.69588, 10.17192, 5.83046, 12.72514, 11.14099, 6.62106, 6.42983, 14.86971, 10.90829, 9.04028, 14.04328, 8.87164, 12.60636, 12.3963, 6.36583, 12.54848, 13.49027, 10.0893, 6.50218, 10.51734, 5.19006, 8.99228, 13.65136, 8.09963, 7.78014, 14.23833, 8.0627, 10.38719, 12.63691, 6.19177, 9.35091, 8.33187, 12.15881, 11.73169, 6.86595, 10.50741, 10.60059, 7.17568, 11.21306, 11.8849, 7.8963, 12.34905, 9.29737, 8.22519, 13.08836, 10.56258, 6.73543, 11.40977, 9.40744, 9.58572, 13.76353, 10.65397, 8.2444, 12.87364, 7.9605, 9.17736, 12.56644, 12.87282, 7.36195, 10.00795, 12.79449, 6.79519, 10.7727, 8.02709, 6.20456, 9.1878, 10.66975, 10.1125, 12.85898, 11.74171, 8.10075, 11.42025, 7.63451, 7.28602, 8.98739, 11.68446, 8.68034, 9.98642, 13.62718, 6.79409, 9.21393, 8.00017, 9.62578, 11.27954, 13.65994, 9.75675, 13.30748, 7.95994, 10.42348, 13.77742, 9.33892, 6.51409, 8.39241, 9.34687, 8.95899, 10.7701, 6.59846, 11.58769, 12.67448, 11.8891, 7.93781, 7.65498, 11.86976, 10.97733, 10.72215, 13.23766, 11.6946, 12.95655, 9.44359, 10.71944, 12.23772, 7.46471, 9.60494, 8.85103, 13.2336, 8.08986, 8.63449, 7.46579, 7.71835, 7.46651, 9.43615, 10.39506, 11.14897, 6.7664, 11.91014, 11.36551, 12.53421, 9.02267, 9.27785, 6.76234, 12.28165, 12.53349, 10.56385, 9.28056, 7.76228, 12.53529, 8.3054, 7.04345, 10.55641, 11.04101, 9.2299, 13.40154, 12.06219, 12.34502, 8.13024, 8.41231, 7.32552, 8.1109, 10.37422, 8.72046, 6.34006, 13.48591, 11.60759, 10.65313, 11.31966, 10.01358, 6.37282, 9.57652, 6.22258, 10.66108, 13.20591, 10.78607, 11.99983, 10.24325, 6.69252, 12.04006, 11.89925, 8.57975, 12.36549, 12.71398, 11.01261, 8.31554, 9.8875, 7.14102, 8.25829, 10.82264, 7.43356, 7.12718, 13.79544, 10.8122, 9.33025, 13.20481, 9.2273, 11.97291, 11.7556, 7.12636, 12.0395, 12.63805, 9.99205, 7.20551, 10.41428, 6.23647, 9.34603, 12.82432, 8.78694, 8.1151, 13.26457, 8.59023, 10.59256, 11.77481, 6.91164, 9.43742, 12.1037, 7.65095, 10.70263, 11.66813, 7.84119, 8.26831, 13.13405, 9.49259, 9.39941]]},
 "stress": {"__ndarray__": [[6], "float64", [8.560229766148888e-05, 2.1714210248947856e-05, 1.2351946560122966e-05, 2.7936994847453462e-05, -2.6432791148115597e-05, -8.418547508991338e-05]]},
 "unique_id": "784d280aebb109df8429939c14c82d24",
 "user": "mse-gucc"},
"ids": [1],
"nextid": 2}