{"1": { "calculator": "unknown", "calculator_parameters": {"energy": -656.13525923}, "cell": {"__ndarray__": [[3, 3], "float64", [20.0, 0.0, 0.0, 0.0, 20.0, 0.0, 0.0, 0.0, 20.0]]}, "ctime": 20.382016813236127, "energy": -656.13525923, "forces": {"__ndarray__": [[96, 3], "float64", [-0.000159, 0.001153, 0.003381, 0.000945, -0.001496, 0.001452, -0.002153, -0.000484, -0.00023, -0.001106, -0.000486, -0.000451, 0.00023, 0.003217, -0.001593, -0.000751, 0.000292, 0.000734, 0.000712, -0.000208, -0.000209, 0.002232, 0.0016, 0.00229, 0.001923, 0.003406, 0.00163, -0.004263, -0.000992, -0.000918, 3.6e-05, 0.002944, -0.002296, 0.000607, 0.000351, -0.000134, 0.000663, 0.001305, 0.001988, -0.000956, 0.00121, -0.00159, 0.001078, 0.000641, -0.000289, -0.000388, -0.002202, 0.002347, -0.001903, -0.000751, 0.003661, -0.000489, 0.003803, 0.001483, -0.001172, 0.004838, -0.001804, -0.000455, -0.001969, 0.001617, 0.002899, 0.001646, -0.000683, -0.001407, 0.000113, -0.005694, 0.00102, -0.000644, 0.001144, -0.002977, 0.000216, 6e-06, 0.002694, -0.001206, 0.000813, 0.001304, 0.000155, -0.002292, 0.00148, -0.000374, 0.00081, 0.004644, -0.003082, 0.000716, -0.001016, -0.002283, -0.001653, 1.9e-05, -0.00061, -0.001736, 0.003096, 0.000545, 0.000202, -0.002269, 0.000158, -0.001249, 0.000799, -0.00266, 0.000577, 0.002094, -0.002029, -0.000139, 0.002861, 0.000347, 0.000204, 0.003305, 0.002134, -8.7e-05, -0.002139, -0.001781, -0.00141, 0.000625, -0.000428, -0.000531, -0.000823, 0.00172, 0.000719, 0.001268, 0.004393, 0.000115, -0.00284, 0.001099, 0.002198, -0.002362, -0.002564, 0.000611, 0.002598, -0.001314, 0.003061, 0.00057, 0.002364, -0.003904, 0.002693, -0.002048, 0.001335, 0.002307, 0.005683, 0.004411, 0.00339, 0.002563, 0.00189, -0.000535, -0.001666, -0.001503, -0.001177, -0.001851, -0.005643, -0.004014, -0.000977, 0.003762, 0.00235, -0.004279, -0.002848, -0.006604, -0.002235, -0.004439, 0.000506, 0.000504, 0.006076, -0.001716, 0.000827, 0.000955, -0.002894, 0.002889, 0.002052, -0.002686, -0.000272, -0.003721, 0.003106, -0.001586, 0.001067, -0.001822, 0.001954, -0.004198, -0.001814, -0.0035, 0.001433, -0.001929, 0.002109, -0.003364, 0.000946, 0.001955, -0.001352, 0.001541, -0.001739, 0.001802, 0.002692, -0.004766, 0.000753, 0.001403, -0.00269, -0.001779, 0.00349, 0.000711, -0.002463, -0.00073, -0.003044, 0.00217, -0.000197, 0.000306, 0.000831, 0.002244, 9.2e-05, -0.00138, 0.001939, 0.001462, 9.2e-05, -0.001219, -0.001504, -0.002555, -0.000791, 0.001853, -0.001782, -0.000314, 0.001274, 0.000959, -0.001374, -0.000362, 0.001127, -0.00224, 0.001892, 0.002658, -0.000638, 0.004223, 0.004731, -0.003896, 0.000765, -0.000449, -0.000576, -0.00172, 0.002979, -0.001384, 0.002219, -0.000128, 0.000795, 0.000686, 0.001451, -0.002231, 1.5e-05, 0.001283, -0.002166, -0.004476, 0.001216, -0.000991, -0.000817, 3e-05, -7.4e-05, -0.000275, 0.00115, 0.007577, -0.001048, -0.001576, -0.001082, -0.004836, 0.003006, 0.002076, 0.004331, -0.005638, -0.003295, -0.001953, -0.002207, 0.00319, -0.000239, -0.000126, -0.001287, 0.000777, -0.001965, -0.001727, -0.002371, -0.004179, -0.002293, 0.000178, -0.0008, -0.001601, 0.00013, -0.003699, 0.001694, 0.0007, 0.00194, -0.001133, 0.001688, 0.00356, 0.001841, 6e-05, -0.002625, 0.000573, -0.003677, 0.002833]]}, "key_value_pairs": {"perms_number": 1}, "mtime": 25.04350012405833, "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", [5.47899, 11.94947, 9.04744, 5.15838, 11.03962, 10.91664, 6.23767, 10.92649, 7.27921, 12.11296, 13.53079, 12.52694, 13.41043, 6.54109, 10.92237, 10.54505, 8.30553, 5.31733, 9.28537, 8.1848, 14.29376, 13.91995, 11.74249, 7.46097, 10.30812, 5.64627, 12.60637, 14.01356, 11.05725, 12.70663, 10.58755, 11.89603, 5.50637, 9.90456, 14.15951, 7.4205, 7.7265, 13.41742, 7.27697, 13.44452, 9.9435, 6.35199, 10.74131, 6.66038, 6.6235, 14.75567, 10.68729, 9.18878, 8.47014, 8.94739, 5.40449, 7.99338, 6.45052, 7.54581, 7.80242, 5.628, 10.74672, 6.28586, 11.58747, 12.69932, 14.02272, 8.46848, 7.75673, 14.08702, 8.8463, 12.46517, 12.23283, 5.68851, 9.2333, 14.40951, 12.14236, 10.82081, 12.77109, 6.76843, 7.39886, 8.38481, 11.1677, 5.51733, 5.2429, 8.81637, 10.75839, 8.92322, 13.29564, 13.58814, 11.40806, 9.03888, 14.59862, 12.36062, 13.23145, 7.46018, 6.69086, 13.73426, 9.17602, 11.69282, 10.06327, 5.27035, 9.53553, 11.41886, 14.67104, 7.29453, 6.87735, 12.79888, 10.08464, 5.55863, 9.45937, 7.69347, 14.24644, 10.99934, 8.04745, 12.28428, 11.80851, 6.20347, 10.8032, 10.67885, 7.02553, 11.23197, 11.93959, 7.37992, 12.89814, 9.35257, 8.10209, 13.25897, 10.68076, 6.47639, 11.58963, 9.33294, 9.60674, 13.36678, 10.60828, 8.28048, 12.81841, 8.04246, 9.14933, 12.50937, 12.82338, 7.66297, 9.96928, 12.4593, 6.98044, 10.78201, 8.10073, 6.27327, 9.21267, 10.67826, 10.17203, 12.94481, 11.80192, 8.26854, 11.38631, 7.64154, 7.15412, 8.83022, 11.85142, 8.80932, 9.9988, 13.22057, 7.22528, 9.33368, 8.27281, 9.59596, 11.21914, 13.57758, 9.74008, 13.25575, 8.06295, 10.33983, 13.41945, 9.43901, 6.93949, 8.59773, 9.4848, 8.92531, 10.80895, 6.42805, 11.63986, 12.71167, 11.93103, 7.8176, 7.47966, 12.02754, 10.99617, 10.70003, 13.26049, 11.67837, 12.8869, 9.45935, 10.60627, 12.09299, 7.60934, 9.60303, 8.74647, 13.38651, 8.08813, 8.65081, 7.48049, 7.63147, 7.42563, 9.48698, 10.38741, 11.26689, 6.41288, 11.91373, 11.35908, 12.55182, 8.91465, 9.2276, 6.37624, 12.31643, 12.53612, 10.59266, 9.3166, 7.72167, 12.29616, 8.09196, 6.69626, 10.71294, 11.07611, 9.20856, 13.55647, 12.00177, 12.37423, 8.08416, 8.35309, 7.32562, 8.14839, 10.42569, 8.73749, 6.32026, 13.47284, 11.57818, 10.6605, 11.33465, 10.01643, 6.30755, 9.61349, 6.9324, 10.8248, 13.20187, 10.77282, 12.01517, 10.322, 6.62744, 12.09884, 11.95961, 8.51887, 12.56884, 13.07661, 11.27711, 7.98834, 9.79975, 7.30323, 8.35077, 10.77599, 7.56298, 7.29089, 13.66381, 10.74614, 9.35791, 13.1757, 9.22258, 11.95662, 11.65309, 7.36905, 11.92378, 12.67883, 9.99701, 7.13677, 10.3566, 6.65428, 9.52312, 13.00527, 8.76627, 8.07351, 13.09219, 8.63389, 10.57749, 11.89009, 6.72127, 9.38595, 12.5708, 7.22438, 10.68086, 12.17382, 7.4682, 7.99988, 13.19388, 9.32858, 9.44785]]}, "stress": {"__ndarray__": [[6], "float64", [0.00012528581268385464, 0.00013501632541110665, 0.00010305355717745849, 1.7445018006843707e-05, 1.3138376709984259e-05, -1.7476225552473123e-07]]}, "unique_id": "b997bdf94e476a3c7f777f96c2c6ba71", "user": "hecc"}, "ids": [1], "nextid": 2}