{"1": { "calculator": "unknown", "calculator_parameters": {"energy": -659.07069696}, "cell": {"__ndarray__": [[3, 3], "float64", [20.0, 0.0, 0.0, 0.0, 20.0, 0.0, 0.0, 0.0, 20.0]]}, "ctime": 20.36965115074551, "energy": -659.07069696, "forces": {"__ndarray__": [[96, 3], "float64", [0.001031, -0.001504, 0.001801, -0.000373, -0.001359, 0.000265, 0.001296, 0.002833, -0.000939, -0.002568, -0.000941, -0.000642, 0.00054, 0.000128, 0.002811, 0.000353, 0.002742, -0.002147, -0.000858, 0.002203, -4e-05, -0.002923, 0.001613, 0.002024, -0.004583, -0.000234, 0.001051, -0.000859, 0.001392, 0.001548, -0.002462, 0.001628, 0.000798, -0.001753, 0.001749, -0.000126, -0.002129, 0.000206, -0.004956, -0.000985, -0.000563, 0.004705, -0.000123, 0.001667, -0.000355, 0.000182, -0.000699, -0.000967, 0.002232, 0.002636, 0.00125, -0.002771, 0.00164, 0.000511, -0.001548, -0.000576, 0.001028, -0.001295, 0.001164, 0.000389, 0.000421, 0.000217, 0.000701, 0.000173, 0.001218, -0.002348, -0.002001, -0.001362, 0.000849, 0.000878, 0.000428, 0.002422, -0.00107, 0.000394, 0.000907, -0.000152, 0.001379, 0.000664, -0.001433, -0.000207, -0.000521, 0.000362, 0.000216, 5e-06, -0.000161, 0.00037, 0.001562, 0.001374, -0.00183, -0.000364, -0.005077, 0.002237, 0.001441, -0.002903, 0.003587, -0.000728, -0.002142, 0.00279, 0.001119, 0.001263, 0.00111, 0.000662, -0.001558, 0.000268, 0.000885, -0.000199, 0.001274, -0.002799, -0.004796, -0.003085, 0.000829, -0.003034, 0.001399, -0.002073, 0.004995, 0.001758, 0.002195, -0.004798, 0.001974, 0.003806, 0.002478, -0.000716, -0.004437, 0.004439, -0.003722, -0.000289, -0.000966, -0.0023, 0.001946, 0.000563, 0.000459, -0.003036, 0.000556, -0.000618, 0.002675, -0.00325, 0.000854, -0.002229, 0.001028, -0.004167, 0.000303, 0.000529, -0.001297, -0.003229, 0.001344, 0.000826, -0.000163, 0.001341, -0.00116, 0.00199, 0.002257, -0.000548, 0.001873, 0.006092, -0.004555, 0.00639, 0.00085, 0.000827, 0.000825, -0.001837, 0.000739, -0.000483, -0.002102, -0.001559, -6.4e-05, 0.002962, 0.007819, -0.001666, -0.00023, -0.001462, -0.002757, -0.000278, -0.000854, 0.001057, 0.00105, -0.00011, 0.001524, 0.001013, -0.001927, -0.003218, 0.005397, 0.004567, -0.00379, 0.002323, 0.000881, -0.00375, 0.00263, -0.002888, -0.002955, 0.000282, 0.001432, -0.003934, 0.004388, -0.002085, 0.001701, 0.000493, 0.000363, 0.003049, -0.000643, 0.003082, -0.001069, -0.005196, -0.002198, 0.002588, -0.001034, -0.002552, 0.001446, 0.002204, -0.000295, -0.000305, 0.000536, -0.001144, -0.000412, -0.001905, -0.002495, -0.00026, -0.002322, -0.002541, -0.00319, 0.002231, -0.002893, 0.000888, -0.000553, 0.001864, -0.002734, -0.000248, -0.001334, 0.001626, -0.000932, 0.000691, -0.004085, 0.000817, 0.000202, 0.001692, 0.000471, 0.003221, -0.001221, -0.000766, 0.001135, 0.000464, 0.002087, -0.000643, 0.003381, 0.001824, -0.002183, -0.003434, 0.000548, -0.002657, -3e-06, 0.004096, -0.000451, 0.000293, 0.000399, -6.2e-05, -0.000905, -0.002402, -0.001486, 0.000514, -0.000848, -0.003297, -8.8e-05, 0.001063, 0.000817, -0.000882, 0.000408, -0.001881, 0.003523, 0.002351, 0.001981, -0.000243, 4e-06, -2.3e-05, 0.000433, -0.003655, -0.000101, 0.000417, -0.000824, -0.000775, -0.00102, 0.00465, 0.001566, 0.001519, 0.000506, -0.004739, 0.001806, 0.003231, 0.000533, -0.005295]]}, "key_value_pairs": {"perms_number": 3}, "mtime": 25.0434119980855, "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", [7.8148, 13.81289, 7.55549, 8.7861, 13.14381, 13.73289, 5.10331, 9.06762, 10.66883, 10.26317, 14.40144, 12.5302, 7.0735, 12.01462, 6.36208, 5.97251, 8.44364, 12.68484, 8.80706, 11.12245, 5.30391, 12.27297, 13.48214, 12.72612, 7.21363, 6.63234, 12.37299, 8.36787, 8.91116, 5.42925, 13.14884, 13.79222, 10.66837, 8.93241, 6.96824, 13.79632, 11.12158, 9.24555, 14.55725, 12.40366, 13.28809, 7.54754, 7.60068, 6.65206, 7.63108, 10.48696, 8.39016, 5.27542, 14.48257, 12.07111, 10.87887, 11.52809, 10.23891, 5.34678, 9.19415, 5.23734, 10.85015, 13.92331, 11.14761, 12.70758, 10.2817, 5.72547, 12.60632, 12.67539, 8.08131, 13.69868, 13.85248, 11.74053, 7.41747, 9.52721, 5.7791, 7.45177, 11.01376, 6.75595, 6.37501, 14.78203, 11.04533, 9.14282, 14.1357, 9.08157, 12.57236, 12.20965, 6.38456, 12.59295, 13.34226, 10.01399, 6.34021, 10.47051, 5.12762, 9.20985, 13.8931, 8.39392, 7.45154, 14.43054, 8.02912, 10.84902, 12.40392, 5.7829, 9.16805, 13.24684, 6.39962, 10.85299, 12.72903, 6.79066, 7.45297, 14.7509, 9.01992, 9.16317, 7.98534, 12.32479, 11.83911, 6.5458, 10.74633, 10.5989, 7.18975, 11.15202, 11.79525, 7.62949, 12.62245, 9.41222, 8.25872, 13.00263, 10.62428, 6.83745, 11.44677, 9.4011, 9.57653, 13.5399, 10.67947, 8.21262, 12.89306, 8.02162, 9.10996, 12.56001, 12.85217, 7.45647, 10.00222, 12.59233, 6.98511, 10.80122, 8.13988, 6.19218, 9.25684, 10.65673, 10.21051, 13.41375, 12.04184, 7.7541, 11.62629, 7.1384, 6.82169, 8.74624, 12.04905, 8.75029, 10.00703, 13.15183, 7.15898, 9.407, 8.25312, 9.56593, 11.18952, 13.21833, 9.68363, 12.96548, 8.24874, 10.30576, 13.33593, 9.49099, 6.85382, 8.67781, 9.45416, 8.88453, 10.82619, 6.3687, 11.69293, 12.85744, 12.01826, 7.79471, 7.49726, 11.99655, 10.90585, 10.75416, 13.11455, 11.64516, 12.94372, 9.47728, 10.62537, 12.17432, 7.55371, 9.56619, 8.87514, 13.19338, 8.08784, 8.69109, 7.49664, 7.75607, 7.59168, 9.49997, 10.29288, 11.11407, 6.79312, 11.86447, 11.43675, 12.46074, 8.85018, 9.24328, 6.37126, 12.50835, 12.88669, 10.66222, 9.12592, 7.51737, 12.85225, 8.29739, 7.11699, 10.63712, 10.97885, 9.28665, 13.45413, 12.00031, 12.4242, 8.12177, 8.31434, 7.35231, 8.12003, 10.36087, 8.73612, 6.30952, 13.49613, 11.63477, 10.67575, 11.24742, 10.03957, 6.40118, 9.52954, 6.28161, 10.68563, 13.14093, 10.83155, 11.98778, 10.21646, 6.67136, 12.05311, 12.12058, 8.4697, 12.8346, 13.03529, 11.29761, 8.00161, 9.70178, 6.70472, 8.01571, 10.77519, 7.47817, 7.16542, 13.72383, 10.83278, 9.3377, 13.21211, 9.2652, 12.0085, 11.70731, 7.18209, 12.03192, 12.61742, 10.02082, 7.16439, 10.3694, 6.20961, 9.36311, 13.02443, 8.76354, 8.00971, 13.44419, 8.47516, 10.6736, 11.85517, 6.71423, 9.35285, 12.51762, 7.19944, 10.67816, 12.10767, 7.50144, 8.01047, 13.69614, 9.25528, 9.34759]]}, "stress": {"__ndarray__": [[6], "float64", [0.0001432988080211537, 0.00014321142689339135, 0.0001278385899163409, 9.037705214278958e-06, -3.0021658895498473e-06, 8.051546772389402e-07]]}, "unique_id": "9546243d159bb7e432b8483457ffcc98", "user": "hecc"}, "ids": [1], "nextid": 2}