{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [20.0, 0.0, 0.0, 0.0, 20.0, 0.0, 0.0, 0.0, 20.0]]},
 "ctime": 20.635543061846228,
 "energy": -663.35504265,
 "forces": {"__ndarray__": [[96, 3], "float64", [0.003521, -0.002114, 9.9e-05, -0.001041, -0.001643, -0.000745, -0.003588, 0.001029, -0.001735, -0.000364, 0.003456, 0.000741, -0.00084, -0.001963, 0.001032, -0.001397, 0.001856, 6.2e-05, -0.00383, 0.000542, -0.005729, 0.000267, 0.002118, 0.002445, -0.001254, -0.000996, -0.0019, -0.00457, 0.000731, -0.002696, -0.002548, 0.000937, 0.003016, -0.002951, -0.004117, 0.000279, -8.4e-05, -6.7e-05, 0.005325, -0.007526, 0.002483, 0.001282, -0.003099, 0.004612, 0.001792, 0.002028, 0.000783, -0.001517, -0.001434, -0.002294, -0.002894, 0.00413, -0.000158, -0.001241, -0.002028, -0.000783, 0.001517, 0.001434, 0.002294, 0.002894, 8.4e-05, 6.7e-05, -0.005325, -0.00413, 0.000158, 0.001241, 0.003099, -0.004612, -0.001792, 0.007526, -0.002483, -0.001282, 0.00457, -0.000731, 0.002696, 0.002951, 0.004117, -0.000279, 0.002548, -0.000937, -0.003016, -0.000267, -0.002118, -0.002445, 0.001254, 0.000996, 0.0019, 0.001397, -0.001856, -6.2e-05, 0.00383, -0.000542, 0.005729, 0.00084, 0.001963, -0.001032, 0.000364, -0.003456, -0.000741, 0.003588, -0.001029, 0.001735, 0.001041, 0.001643, 0.000745, -0.003521, 0.002114, -9.9e-05, -0.005875, -0.011523, -0.000374, 0.000277, -0.013945, 0.014313, 0.002977, -0.004387, -0.002544, -0.010541, 0.008231, 0.002164, -0.009529, 0.013751, 0.001939, 0.005923, 0.001015, -0.006865, -0.003103, -0.00432, 0.008245, -0.007289, -0.006122, 0.00307, -0.003194, -0.009983, -0.00291, -0.001256, -0.001935, 0.002682, -0.001996, -0.005553, 0.00922, 0.001403, -0.004316, -0.003745, 0.003816, -0.000449, -0.007425, 0.015463, 0.003321, -0.00054, 0.00254, -0.005751, -0.000546, -0.003288, -0.004519, 0.006357, 0.00232, -0.007779, -0.001109, 0.004881, -0.009106, 0.005721, 0.018443, -0.000555, -0.000849, 0.013046, -0.008055, -0.020141, -0.005252, 0.000748, -0.00274, 0.008783, -0.005117, -0.004161, 0.009154, -0.006249, 0.000245, -0.004424, 0.00097, 0.002537, 0.006095, 0.002771, 0.003943, 0.005223, 0.002736, 0.003862, -0.000978, -0.001285, -0.002923, 0.002861, -0.004405, 0.003776, -0.001762, 5.5e-05, -0.009763, -0.000614, -0.002753, -0.001867, -0.002861, 0.004405, -0.003776, 0.001762, -5.5e-05, 0.009763, -0.006095, -0.002771, -0.003943, 0.000614, 0.002753, 0.001867, 0.000978, 0.001285, 0.002923, -0.005223, -0.002736, -0.003862, -0.008783, 0.005117, 0.004161, 0.004424, -0.00097, -0.002537, -0.009154, 0.006249, -0.000245, -0.004881, 0.009106, -0.005721, 0.005252, -0.000748, 0.00274, 0.003288, 0.004519, -0.006357, -0.013046, 0.008055, 0.020141, -0.00232, 0.007779, 0.001109, -0.018443, 0.000555, 0.000849, -0.015463, -0.003321, 0.00054, -0.00254, 0.005751, 0.000546, -0.003816, 0.000449, 0.007425, 0.003194, 0.009983, 0.00291, -0.001403, 0.004316, 0.003745, 0.001996, 0.005553, -0.00922, 0.007289, 0.006122, -0.00307, 0.001256, 0.001935, -0.002682, 0.003103, 0.00432, -0.008245, -0.002977, 0.004387, 0.002544, -0.005923, -0.001015, 0.006865, 0.009529, -0.013751, -0.001939, 0.010541, -0.008231, -0.002164, 0.005875, 0.011523, 0.000374, -0.000277, 0.013945, -0.014313]]},
 "free_energy": -663.35857113,
 "key_value_pairs": {"perms_num": 8},
 "mtime": 25.083352236765187,
 "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", [6.7855, 13.42784, 9.05003, 7.73462, 14.11662, 10.94903, 6.55194, 10.20232, 13.51197, 5.20506, 9.22347, 10.81631, 6.00556, 8.36789, 12.5885, 8.24736, 10.02111, 14.74096, 5.8068, 9.22458, 7.41601, 9.39567, 11.83316, 14.59757, 5.44465, 7.98465, 9.13536, 8.44394, 11.13978, 5.40267, 12.03233, 13.74855, 12.58382, 7.21401, 6.70508, 12.58957, 11.40573, 11.02243, 14.81128, 12.2212, 14.32223, 9.18292, 10.873, 13.34165, 6.48729, 9.4784, 8.32679, 14.74093, 7.14844, 7.92734, 6.29238, 6.67603, 6.2897, 9.13477, 10.5216, 11.67321, 5.25907, 12.85156, 12.07266, 13.70762, 8.59427, 8.97757, 5.18872, 13.32397, 13.7103, 10.86523, 9.127, 6.65835, 13.51271, 7.7788, 5.67777, 10.81708, 11.55606, 8.86022, 14.59733, 12.78599, 13.29492, 7.41043, 7.96767, 6.25145, 7.41618, 10.60433, 8.16684, 5.40243, 14.55535, 12.01535, 10.86464, 11.75264, 9.97889, 5.25904, 14.1932, 10.77542, 12.58399, 13.99444, 11.63211, 7.4115, 14.79494, 10.77653, 9.18369, 13.44806, 9.79768, 6.48803, 12.26538, 5.88338, 9.05097, 13.2145, 6.57216, 10.94997, 8.11156, 12.18905, 11.81224, 6.70517, 10.64817, 10.55902, 7.32115, 11.09545, 11.7924, 7.54556, 12.68046, 9.33519, 8.20952, 13.16237, 10.66389, 6.90775, 11.31503, 9.40373, 9.70534, 13.34674, 10.59579, 8.50199, 12.4717, 8.18723, 9.36077, 12.19457, 12.54845, 7.37781, 9.99502, 12.80909, 7.17265, 10.60256, 8.16873, 6.29517, 9.20801, 10.64171, 10.29967, 12.87571, 11.83135, 8.11109, 11.2846, 7.45192, 6.88977, 8.69605, 12.02777, 8.66198, 9.99295, 13.72494, 6.76379, 9.19677, 7.96771, 9.61457, 11.26978, 13.67241, 9.78539, 12.88667, 8.20726, 10.4018, 13.33525, 9.44048, 6.45207, 8.38639, 9.30425, 8.91204, 10.75744, 6.32779, 11.76278, 12.82973, 12.03202, 7.79942, 7.44385, 12.02809, 11.11687, 10.81248, 13.77286, 11.89758, 13.28124, 9.35798, 10.81482, 12.49262, 7.19064, 9.57961, 8.73006, 13.7249, 7.77052, 8.3795, 7.07629, 7.36988, 7.12328, 9.30456, 10.42039, 11.26994, 6.2751, 12.22948, 11.6205, 12.92371, 8.88313, 9.18752, 6.22714, 12.63012, 12.87672, 10.69544, 9.18518, 7.50738, 12.80936, 8.10242, 6.71876, 10.64202, 11.08796, 9.24256, 13.67221, 12.20058, 12.55615, 7.97191, 8.23722, 7.17027, 7.96798, 10.38543, 8.73022, 6.32759, 13.54793, 11.61361, 10.69575, 11.33802, 10.00705, 6.27506, 9.5982, 6.66475, 10.55952, 13.23621, 10.80323, 12.03229, 10.21461, 7.11333, 11.79274, 11.88891, 8.7154, 12.54808, 13.11023, 11.30395, 7.97223, 9.70033, 7.12429, 8.16865, 10.63923, 7.80543, 7.45155, 13.70483, 10.79199, 9.35829, 12.82735, 9.39744, 11.83127, 11.49801, 7.5283, 11.81277, 12.62219, 10.00498, 7.19091, 10.29466, 6.65326, 9.40421, 12.67885, 8.90455, 8.2076, 13.09225, 8.68497, 10.59627, 11.79048, 6.83763, 9.33611, 12.45444, 7.31954, 10.66481, 11.88844, 7.81095, 8.18776, 13.29483, 9.35183, 9.44098]]},
 "stress": {"__ndarray__": [[6], "float64", [0.00011302748876061992, 0.0001538531999530223, 0.00010200498364431008, -8.113961863648235e-07, 3.1269960720675124e-06, -1.5079486048133952e-05]]},
 "unique_id": "9049ec7ba4e52f60f9273482ace1f6b2",
 "user": "mse-gucc"},
"ids": [1],
"nextid": 2}