{"1": { "calculator": "unknown", "calculator_parameters": {"energy": -660.93197653}, "cell": {"__ndarray__": [[3, 3], "float64", [20.0, 0.0, 0.0, 0.0, 20.0, 0.0, 0.0, 0.0, 20.0]]}, "ctime": 20.36964257426996, "energy": -660.93197653, "forces": {"__ndarray__": [[96, 3], "float64", [0.002956, -0.000655, 0.000756, -0.001963, -0.002353, -0.001253, -0.002421, -0.002447, -0.002656, -0.00027, -0.0011, 0.000396, 0.001695, 0.001248, -0.000687, -0.000299, -0.000328, -0.001221, 0.001233, 0.000844, 0.002483, -0.000239, -0.00248, -0.00179, 0.00064, -3.8e-05, -0.001952, -0.000686, -0.004518, -0.00334, 1.7e-05, -0.000167, -0.000753, 0.00405, -0.000802, 0.003107, -0.001651, -0.00065, -0.000292, -0.000493, 0.000434, 0.001438, -0.003868, -0.000996, 0.001234, -0.001676, -0.000159, -0.003537, 0.003086, 0.000489, 0.001196, 0.000767, -0.002263, -0.000702, 0.001676, 0.000159, 0.003537, -0.003086, -0.000489, -0.001196, 0.000493, -0.000434, -0.001438, -0.000767, 0.002263, 0.000702, 0.003868, 0.000996, -0.001234, -0.00405, 0.000802, -0.003107, 0.001651, 0.00065, 0.000292, 0.000686, 0.004518, 0.00334, -1.7e-05, 0.000167, 0.000753, 0.000239, 0.00248, 0.00179, -0.00064, 3.8e-05, 0.001952, -0.001233, -0.000844, -0.002483, 0.000299, 0.000328, 0.001221, 0.002421, 0.002447, 0.002656, -0.001695, -0.001248, 0.000687, 0.00027, 0.0011, -0.000396, 0.001963, 0.002353, 0.001253, -0.002956, 0.000655, -0.000756, 0.00121, -0.000708, -0.004186, 0.006965, -0.003531, 0.004685, -0.004517, -0.005753, -0.004462, -0.005533, -0.004312, -0.001302, 0.002249, 0.001081, 0.00569, -0.001467, -0.002609, 0.004415, 0.000631, -7.7e-05, -0.003735, 0.003105, -0.003474, 0.001587, 0.001406, -0.003296, 0.004102, 0.000745, -0.000741, -0.003239, 0.000402, 0.000628, -0.002465, -0.00019, -0.007628, 0.001222, -8.7e-05, 0.001063, 0.00242, 0.00378, -0.000398, -0.004132, 0.003752, -0.006176, -0.004225, -0.001458, -0.001178, -0.003461, 0.002232, -0.005763, -0.000915, -0.00065, 0.000904, 0.001103, 0.00105, 0.002656, -0.000201, 0.001837, -0.004754, -0.001034, 0.00147, 0.003819, 0.000435, -0.001152, -0.001223, 0.001139, 0.001963, -0.004563, 0.001701, -0.006153, -5e-05, -0.001841, -0.002392, -0.00497, 0.001712, 0.004162, -0.003075, -0.000508, -0.002422, -0.001307, -0.002432, 0.000152, -0.005516, -0.00236, 0.005748, 0.005863, 0.004384, 0.000543, -0.002472, -0.000439, -0.000152, 0.005516, 0.00236, -0.005748, -0.005863, -0.004384, 0.002392, 0.00497, -0.001712, -0.000543, 0.002472, 0.000439, 0.002422, 0.001307, 0.002432, -0.004162, 0.003075, 0.000508, 0.001152, 0.001223, -0.001139, 0.006153, 5e-05, 0.001841, -0.001963, 0.004563, -0.001701, 0.00065, -0.000904, -0.001103, -0.00147, -0.003819, -0.000435, 0.001458, 0.001178, 0.003461, -0.001837, 0.004754, 0.001034, -0.002232, 0.005763, 0.000915, -0.00105, -0.002656, 0.000201, -0.00378, 0.000398, 0.004132, -0.003752, 0.006176, 0.004225, 8.7e-05, -0.001063, -0.00242, -0.001406, 0.003296, -0.004102, 0.00019, 0.007628, -0.001222, -0.000402, -0.000628, 0.002465, -0.003105, 0.003474, -0.001587, -0.000745, 0.000741, 0.003239, -0.000631, 7.7e-05, 0.003735, 0.004517, 0.005753, 0.004462, 0.001467, 0.002609, -0.004415, -0.002249, -0.001081, -0.00569, 0.005533, 0.004312, 0.001302, -0.00121, 0.000708, 0.004186, -0.006965, 0.003531, -0.004685]]}, "key_value_pairs": {"perms_number": 4}, "mtime": 25.694273165656465, "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", [5.54036, 12.07255, 9.31589, 9.40293, 14.88065, 10.68326, 8.71942, 13.21887, 13.51146, 5.78874, 11.01713, 7.39242, 5.29102, 9.11729, 10.98311, 10.33147, 14.31889, 12.60639, 7.33386, 12.21026, 6.48653, 8.11085, 9.97175, 14.56479, 5.82661, 8.97441, 7.4205, 9.44929, 11.65173, 14.68872, 5.47157, 7.99913, 9.19808, 8.60014, 11.03167, 5.3102, 12.26209, 13.65341, 12.57829, 11.39327, 11.01435, 14.67494, 12.28928, 14.20846, 9.01781, 9.38952, 8.21223, 14.56421, 7.24739, 7.99796, 6.36479, 6.69965, 6.30962, 9.19893, 10.61048, 11.78777, 5.43579, 12.75261, 12.00204, 13.63521, 8.60673, 8.98565, 5.32506, 13.30035, 13.69038, 10.80107, 7.71072, 5.79154, 10.98219, 11.39986, 8.96833, 14.6898, 7.73791, 6.34659, 7.42171, 10.55071, 8.34827, 5.31128, 14.52843, 12.00087, 10.80192, 11.88915, 10.02825, 5.43521, 14.17339, 11.02559, 12.5795, 12.66614, 7.78974, 13.51347, 9.66853, 5.68111, 7.39361, 11.28058, 6.78113, 6.48854, 14.70898, 10.88271, 9.01689, 14.21126, 8.98287, 12.60758, 10.59707, 5.11935, 9.31674, 14.45964, 7.92745, 10.68411, 8.13295, 12.265, 11.73943, 6.63197, 10.69578, 10.56047, 7.32563, 11.08911, 11.68147, 7.67392, 12.53669, 9.39261, 8.30327, 12.99345, 10.60671, 6.52036, 11.5476, 9.34686, 9.59965, 13.78652, 10.65307, 8.42002, 12.47368, 8.25982, 9.17459, 12.51709, 12.78857, 7.62037, 9.96487, 12.52435, 6.69797, 10.7869, 7.96286, 6.34863, 9.22838, 10.65909, 10.26975, 13.38307, 12.03576, 7.86008, 11.56089, 7.21011, 7.1894, 8.82901, 11.86413, 8.64725, 10.00625, 13.60432, 6.73253, 9.21174, 7.99089, 9.5815, 11.28223, 13.66335, 9.78776, 12.8788, 8.31856, 10.37551, 13.41616, 9.44002, 6.4772, 8.41473, 9.3388, 8.91035, 10.79256, 6.33582, 11.75743, 12.86462, 12.00761, 8.01919, 7.68626, 11.86425, 11.0767, 10.78406, 13.6509, 11.85906, 13.2356, 9.34085, 10.76699, 12.25286, 7.47615, 9.5882, 8.71214, 13.60391, 7.84314, 8.43144, 7.1762, 7.40529, 7.13785, 9.3395, 10.4118, 11.28786, 6.39609, 12.15686, 11.56856, 12.8238, 8.9233, 9.21594, 6.3491, 12.59471, 12.86215, 10.6605, 9.23301, 7.74714, 12.52385, 8.14094, 6.7644, 10.65915, 11.08965, 9.20744, 13.66418, 11.98081, 12.31374, 8.13575, 8.24257, 7.13538, 7.99239, 10.4185, 8.71777, 6.33665, 13.5228, 11.58527, 10.6612, 11.35275, 9.99375, 6.39568, 9.62449, 6.58384, 10.55998, 13.26747, 10.78826, 12.00911, 10.21224, 7.1212, 11.68144, 12.13992, 8.43911, 12.78989, 12.8106, 11.17099, 8.13587, 9.73025, 6.61693, 7.96424, 10.82541, 7.48291, 7.21143, 13.65137, 10.77162, 9.34091, 13.30203, 9.2131, 12.03714, 11.57998, 7.52632, 11.74018, 12.37963, 10.03513, 7.47565, 10.40035, 6.21348, 9.34693, 12.67437, 8.91089, 8.31853, 13.47964, 8.4524, 10.65314, 11.69673, 7.00655, 9.39329, 12.32608, 7.46331, 10.60739, 11.86705, 7.735, 8.26057, 13.36803, 9.30422, 9.43953]]}, "stress": {"__ndarray__": [[6], "float64", [0.00015093841519123484, 0.00015312918489441985, 0.0001598949807868773, 9.911516491902614e-06, 2.0484632951148853e-05, -1.2932406908830111e-05]]}, "unique_id": "e07ce35d680eca12ea4364c96970b1e7", "user": "hecc"}, "ids": [1], "nextid": 2}