{"1": { "calculator": "unknown", "calculator_parameters": {"energy": -657.42410462}, "cell": {"__ndarray__": [[3, 3], "float64", [20.0, 0.0, 0.0, 0.0, 20.0, 0.0, 0.0, 0.0, 20.0]]}, "ctime": 20.36964717624231, "energy": -657.42410462, "forces": {"__ndarray__": [[96, 3], "float64", [-2.5e-05, -0.000292, -0.001223, 0.000402, 0.000477, -0.000182, -0.001113, -0.001383, -0.000245, -0.001756, 0.000775, -0.00329, -0.002302, -0.000805, 0.001958, 0.000214, 0.002301, 0.000385, -0.001456, 0.000684, -0.00157, -0.000327, 0.00146, -0.000108, -0.000412, 9.3e-05, 0.002969, -0.00219, -0.000351, -0.001249, 0.000125, 0.003347, -0.002045, -0.000573, 0.000528, 0.000848, 0.000591, 0.002189, -0.000972, -0.001964, -0.001196, -0.001093, 0.000724, 0.000176, 0.001263, -0.000108, 0.000464, 0.00273, -0.000143, 0.000323, -0.000147, 0.0003, 0.000148, 0.001198, 0.000129, -0.000475, 0.000317, 0.000194, -0.000244, 0.000419, -0.000624, 0.002293, -0.000512, -0.000505, -1.8e-05, 0.00038, 0.000577, 0.000789, -0.000183, -4.1e-05, 0.001036, 0.000224, -0.000743, -0.000516, 0.000847, -0.000349, 0.000488, -0.001312, 0.000379, -0.001116, 0.001189, 0.000607, -1.6e-05, 0.001563, 0.00127, 0.000307, 0.000987, -0.000404, 5.5e-05, -0.000594, 0.001505, -0.000932, -0.001031, 0.001073, 0.000257, 6.4e-05, 0.000954, -0.001496, 0.001443, 0.002017, -0.001144, 0.001114, 0.002257, -0.002127, -0.001019, 0.001889, -0.000598, 0.000151, -0.001134, -0.002049, -0.003443, 0.004047, 0.002783, 0.00143, 0.001684, 0.001074, 0.001955, 0.000623, -0.002105, -0.001251, 0.000263, 0.002513, 0.001448, -0.004194, -0.0027, -0.003849, -0.002511, -0.001693, 0.000657, -0.00239, -0.002073, 0.001611, -0.001345, -0.000893, -0.001022, -0.001589, 1.4e-05, 0.001138, 0.000329, 0.004906, 0.00282, -0.000836, 0.002924, 0.00303, 0.006679, -0.000476, 0.00063, 0.000302, -0.001457, -0.004583, -0.002732, 0.002398, 0.000894, 0.002093, 0.000401, -0.001911, 0.001152, -0.004083, -0.002867, -0.000621, -0.00043, 0.000696, 0.003207, -0.000541, 0.003926, 0.000249, -0.002578, -0.002961, -6.7e-05, 0.00353, -0.001092, -0.00414, 0.002694, 0.001465, -0.00917, 0.001686, 0.002226, 0.001771, -0.00625, 6.4e-05, -0.004838, 0.002984, 0.000741, 0.006534, -0.003258, 0.001427, -0.00356, 0.00154, -0.002692, 0.004969, -0.00581, -0.003064, 0.001311, -0.000177, -0.000294, -0.000408, -0.000842, 0.000513, 0.001278, -0.000291, 0.001098, -0.00026, 0.000632, -0.001514, 0.004101, 0.000153, 0.002464, -0.000629, -0.000771, -0.00383, -0.000343, 0.004606, 0.001108, 0.000493, 0.002108, 0.001838, -0.001043, -0.000652, -0.000883, 0.001792, -0.000822, -0.001387, 0.000741, -0.004477, 0.003292, -4.7e-05, -0.000873, 0.000134, 0.001118, -0.002289, 0.000135, -0.000657, -0.000229, -0.002762, -0.002555, 0.002145, 0.002308, 0.000426, 0.001216, -0.000165, -0.000729, 0.00033, -0.000382, -0.000971, 0.001479, 0.000581, -0.001558, -0.002403, -0.00064, 0.001439, -0.000295, -0.001248, -0.000502, -0.000604, -0.001239, 0.001997, 0.001734, -0.000235, 0.000506, 0.001769, 0.000389, 0.000364, -6.5e-05, -0.000188, 0.000556, 0.000182, -0.001403, -0.000428, -0.000931, 0.001242, 4.2e-05, -0.000313, 5.6e-05, 0.000254, -0.000271, -0.001336, 0.002325, -0.000843, 0.001564, -0.000365, 0.002579, 0.000368, -0.000535, -0.00103, -0.000323, -0.002663, 0.000715, 4.3e-05]]}, "key_value_pairs": {"perms_number": 3}, "mtime": 25.083384665860635, "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", [7.75798, 13.63213, 7.43235, 8.94532, 13.25597, 13.61642, 5.20204, 8.99421, 10.85704, 11.17023, 11.12921, 14.70164, 10.8638, 13.38329, 6.45607, 6.53217, 6.53517, 9.18076, 10.26236, 11.63231, 5.32746, 12.63791, 12.23284, 13.54932, 8.37818, 9.13226, 5.5023, 12.98293, 13.74221, 10.82503, 8.76862, 7.02605, 13.64164, 7.43745, 5.88918, 11.04084, 11.0976, 8.9306, 14.66417, 12.68959, 13.38833, 7.68272, 7.68153, 6.61799, 7.30905, 10.41101, 8.41066, 5.29942, 14.41764, 12.12218, 10.86263, 11.66982, 10.07538, 5.30423, 9.38522, 5.12785, 10.8549, 14.10306, 11.04912, 12.62368, 10.23642, 5.78615, 12.64311, 12.71071, 8.05488, 13.68357, 13.88578, 11.70695, 7.41462, 9.57148, 5.75688, 7.44751, 10.99907, 6.78991, 6.37293, 14.75816, 11.0568, 9.16791, 14.10819, 9.04733, 12.57385, 12.17491, 6.3904, 12.58862, 13.36084, 10.02772, 6.37674, 10.47695, 5.14928, 9.17525, 13.86552, 8.40658, 7.46087, 14.40334, 8.04727, 10.85028, 12.383, 5.80635, 9.17641, 13.22359, 6.41862, 10.85632, 12.70604, 6.80776, 7.46321, 14.72382, 9.03159, 9.16815, 7.9054, 12.38159, 11.8582, 6.46892, 10.80338, 10.61431, 7.12074, 11.21762, 11.81615, 7.55071, 12.68208, 9.43045, 8.17704, 13.05928, 10.62955, 6.75725, 11.49389, 9.42579, 9.5496, 13.5064, 10.63604, 8.2297, 12.84038, 8.05267, 9.12297, 12.52835, 12.79585, 7.49244, 10.04686, 12.57506, 6.99126, 10.77888, 8.1935, 6.25816, 9.27491, 10.65658, 10.18869, 13.01953, 11.82186, 8.01958, 11.45173, 7.45788, 7.17869, 8.87966, 11.80652, 8.80863, 10.05842, 13.13134, 7.1754, 9.36793, 8.32013, 9.59541, 11.20238, 13.27155, 9.70032, 12.99488, 8.19528, 10.28234, 13.28864, 9.42912, 6.8254, 8.62459, 9.44818, 8.99101, 10.77611, 6.78103, 11.46814, 12.54947, 11.81935, 8.00024, 7.79336, 11.76232, 11.01249, 10.83732, 13.64312, 11.62451, 12.90634, 9.41661, 10.74778, 12.56543, 7.19643, 9.61923, 8.9233, 13.18443, 8.09791, 8.65142, 7.55692, 7.38191, 7.22451, 9.36402, 10.3346, 11.30806, 6.38586, 12.07517, 11.61461, 12.8201, 8.88679, 9.29516, 6.48567, 12.41275, 12.79321, 10.66204, 9.13083, 7.59702, 12.74995, 8.03994, 6.75083, 10.68714, 11.00224, 9.26044, 13.60737, 12.07405, 12.53935, 8.05004, 8.23201, 7.25271, 8.03637, 10.35535, 8.77037, 6.33524, 13.45475, 11.62439, 10.68923, 11.29056, 10.0508, 6.33324, 9.5213, 6.2024, 10.68193, 13.20175, 10.83051, 12.03805, 10.19232, 6.69657, 12.0311, 12.11861, 8.47787, 12.86214, 13.03386, 11.31882, 7.98701, 9.67952, 6.69192, 8.01167, 10.75783, 7.50096, 7.17235, 13.69799, 10.84187, 9.34826, 13.18622, 9.26953, 12.02327, 11.68227, 7.19675, 12.03194, 12.60674, 10.04447, 7.17276, 10.34658, 6.22308, 9.3559, 12.9982, 8.78051, 8.01737, 13.41601, 8.4919, 10.67928, 11.83031, 6.73537, 9.35862, 12.49359, 7.21828, 10.68439, 12.08291, 7.51872, 8.01829, 13.66973, 9.26986, 9.35222]]}, "stress": {"__ndarray__": [[6], "float64", [9.756102914668123e-05, 0.0001175088923130041, 0.00013489149522858898, -1.4380437026035026e-05, 9.799169327636717e-07, -2.9397507982910145e-06]]}, "unique_id": "f3c97ab097afb7fefb89d0f62794209f", "user": "hecc"}, "ids": [1], "nextid": 2}