{"1": { "calculator": "unknown", "calculator_parameters": {"energy": -527.27449865}, "cell": {"__ndarray__": [[3, 3], "float64", [20.0, 0.0, 0.0, 0.0, 20.0, 0.0, 0.0, 0.0, 20.0]]}, "ctime": 20.351457342847805, "energy": -527.27449865, "forces": {"__ndarray__": [[60, 3], "float64", [-0.001067, -0.000992, -0.001394, 0.006215, 0.003264, 0.006121, 0.003492, -0.002696, -0.003056, -0.002194, 0.001643, -0.001733, -0.002005, -0.001138, 0.00233, -0.000494, -0.003484, -0.001388, -0.002768, 0.001355, 0.00247, 0.00222, 0.000166, -0.000472, 0.00031, -0.000776, -0.000841, -0.001564, 0.001903, -0.00342, 0.001154, 3.1e-05, -0.003372, -0.003741, -0.004093, -0.005029, 0.007757, 9.4e-05, 0.00119, 0.002832, -0.002334, 0.005008, 0.000481, -0.003879, 0.002537, -0.003732, 0.000816, 0.000919, -0.001585, -0.003533, -0.003435, -0.003242, -0.003996, 0.000485, 0.000845, -0.000916, 7.9e-05, -0.000249, -0.003301, 0.001243, -0.006525, -0.001563, 0.001313, -0.00031, 0.00069, 0.000654, -0.00057, 0.004337, -0.00107, -0.000706, 0.004904, -0.002397, -0.001505, 0.001161, 0.001601, -0.001713, 0.001264, -0.005605, -0.00368, -0.002642, 0.002566, -0.001284, -0.00207, -0.003146, 0.002284, 0.001204, 0.004294, 0.001162, 0.002434, 0.003437, -0.000449, 0.000179, 0.000455, -0.003601, 0.005654, 0.000397, -6.4e-05, 0.001203, 0.00324, -0.006881, 0.000361, 0.001332, -0.003375, -0.00244, -0.000557, -0.003156, 0.007003, -0.004379, 0.004586, -0.003681, -0.003841, 0.002199, 0.001696, 0.00131, 0.004916, -0.001238, 0.001649, 0.001827, -0.002046, -2.3e-05, -0.004761, 0.005284, 0.001412, -0.003797, -0.000346, -0.002248, -0.001835, -0.001463, -0.002487, 0.003124, 0.00031, -0.004616, -0.00134, -5.4e-05, -0.000531, -0.000648, 0.001689, 0.004694, 0.002758, 0.00702, -0.0003, -0.000696, 0.001901, 0.001025, 0.003782, 0.001945, -0.002137, 0.003738, -0.001405, -0.000416, -0.002007, -0.00227, 0.002072, 0.002028, 0.002437, -0.002574, 0.001248, -0.001366, 0.002122, -0.002089, 0.000468, -0.00094, 0.003378, -0.008048, 0.00069, 0.005375, -0.003564, -0.001508, 0.004754, -0.000617, 0.003249, 0.001677, 0.004731, 0.005066, 0.001824, -0.001632, -0.000868, -0.002332, 0.000433, -0.001176]]}, "key_value_pairs": {"gap": 0.9728790000000003, "symmetry_op_number": 1}, "mtime": 25.580746553363042, "numbers": {"__ndarray__": [[60], "int32", [5, 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, 7]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]}, "positions": {"__ndarray__": [[60, 3], "float64", [13.37375, 8.50057, 10.61821, 8.00284, 12.3008, 11.82943, 11.94995, 11.41392, 12.58334, 8.99523, 9.2706, 6.66851, 12.34061, 12.56654, 10.58378, 9.23067, 7.69005, 12.59858, 8.24466, 6.9901, 10.58862, 10.99414, 9.26923, 13.32703, 11.97411, 12.3049, 8.16257, 8.41384, 7.42116, 8.18069, 10.37237, 8.8284, 6.66687, 13.21601, 11.41105, 10.59043, 11.22372, 10.00034, 6.66895, 9.63306, 6.6062, 10.58285, 12.97374, 10.68798, 11.84899, 10.24602, 6.99019, 11.82219, 11.98425, 8.58347, 12.61231, 12.79846, 11.17631, 8.16402, 9.75435, 7.03686, 8.20675, 10.75921, 7.71579, 7.43778, 13.45024, 10.71599, 9.38471, 13.04566, 9.29234, 11.91494, 11.58293, 7.41023, 11.81936, 12.41263, 10.00044, 7.40732, 12.83879, 8.83285, 8.17251, 11.72882, 6.99457, 9.41843, 12.37249, 7.30939, 10.6162, 10.37063, 11.17717, 6.66031, 11.99101, 7.69055, 8.17989, 7.64628, 7.42444, 9.40482, 9.605, 8.82119, 13.32249, 6.55748, 10.72485, 10.59564, 7.17577, 11.17331, 11.83182, 7.64611, 12.59643, 9.4021, 8.24266, 13.02746, 10.59254, 6.797, 11.41883, 9.40275, 9.62224, 13.47911, 10.59516, 8.4097, 12.59693, 8.16643, 9.2404, 12.29873, 12.59056, 7.55654, 9.99655, 12.59495, 7.02609, 10.69489, 8.16227, 6.55834, 9.27481, 10.59265, 10.24047, 13.02331, 11.82452, 8.02046, 8.57042, 7.39247, 8.0269, 11.42208, 7.39933, 8.75165, 9.99381, 13.32588, 7.01681, 9.29674, 8.15719, 9.60833, 11.1679, 13.32709, 9.74046, 13.02715, 8.16775, 10.36203, 13.47089, 9.40544, 6.77207, 8.57762, 9.39625, 8.99036, 10.72657, 6.66259, 11.56812, 12.57851, 11.81815, 7.99856, 7.69119, 11.83794, 10.98919, 10.71922, 13.32912, 11.74152, 13.02375, 9.39887, 10.73886, 12.30492, 7.39913, 7.17344, 8.82209, 11.83152, 13.55162, 9.26774, 9.3422, 10.35133, 6.60058, 9.41482]]}, "stress": {"__ndarray__": [[6], "float64", [6.474941567191293e-05, 2.8729666506440637e-05, 3.925285089267981e-05, 1.2439327687885333e-05, 6.828210983716285e-06, 5.9481581969667454e-06]]}, "unique_id": "8b0404bedca559ace6343e9442dd81ec", "user": "hecc"}, "ids": [1], "nextid": 2}