{"1": { "calculator": "unknown", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [15.835022201402165, 0.0, 0.0, 0.0, 16.489663300143434, 0.0, 0.0, 0.0, 18.169744886120114]]}, "__ase_objtype__": "cell"}, "ctime": 24.549368004950132, "dipole": {"__ndarray__": [[3], "float64", [50.788991611498325, 23.170593287324884, -0.05724469926535046]]}, "energy": -142.99696245463042, "forces": {"__ndarray__": [[48, 3], "float64", [1.55e-06, 0.00209357, 0.00216026, -0.00656429, -0.00103528, -0.00246295, -4.652e-05, -4.841e-05, 0.00145015, 0.00066098, 0.00335016, 0.00181146, -0.00090084, 0.00198611, -0.00242555, -0.00167158, -0.00029641, -0.00576667, -0.0005314, -0.00223545, 0.00633586, -0.00365902, 0.00048786, 0.00167928, -0.00208094, 0.0011432, -0.0020864, -0.00211491, 0.00223906, -0.00431931, -7.2e-05, -0.00378026, -0.00233036, 0.00275608, 0.00231365, -0.0043329, 0.00190338, 0.00061377, 0.00370786, -0.00072373, 0.00389406, 0.00294157, -0.00040794, 0.00578559, 0.00031588, 0.00101248, 0.00183785, 0.00146569, -0.00031988, 0.00076902, -0.00238142, 0.00301095, -0.00407815, 0.00237523, 0.00300995, -0.00659156, -0.00058695, 0.00403692, 0.0027753, 0.00221829, 4.202e-05, -0.00039746, 0.0036492, 0.00074297, 0.00223937, -0.00258853, 0.00170567, -0.00018892, 0.00049687, -0.00045255, -0.00126825, 0.00290172, -0.00036484, 0.00172646, -0.00061714, -0.00112452, 0.00138549, 0.00156201, 0.00044894, 0.0003012, 5.133e-05, 0.00098253, -0.00228021, -0.00414461, -0.00394561, 0.00678869, -0.00144449, -7.622e-05, 0.00597897, 0.00326475, -0.00312875, -0.00201945, 0.00080364, 0.00113163, -0.00224267, -0.00066304, -0.0013308, -0.00104406, -0.0018411, 0.00205757, -0.0024096, -0.00031181, -0.00326344, -0.00294068, 0.00144049, 0.00139427, -0.00269417, -0.00090567, 0.00224678, -0.00122985, -0.00201974, 0.00531012, 0.00524823, 0.00170898, -0.0040138, 0.00139133, -0.00323885, 0.00156855, -0.00401266, -0.00324723, -0.00098725, -0.00467022, 0.00589524, 0.00118834, -0.00116899, 0.00022997, 0.00033005, 0.00066812, 0.00089208, 0.00434599, -0.0056688, -0.00138855, 0.00050973, -0.00454861, -0.00127509, 0.00015187, -0.00086052, 0.00278327, -0.00031794, 0.00533593, -0.00045774, -0.00263424, -0.0025975, -0.00163928]]}, "initial_magmoms": {"__ndarray__": [[48], "float64", [0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]]}, "magmom": 1.110975263049603e-13, "magmoms": {"__ndarray__": [[48], "float64", [-0.0, -0.0, -0.0, -0.0, 0.0, 0.0, -0.0, -0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, -0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, -0.0, 0.0, -0.0, 0.0, 0.0, -0.0, 0.0, 0.0]]}, "mtime": 24.549368004950132, "numbers": {"__ndarray__": [[48], "int64", [35, 35, 34, 34, 34, 35, 47, 47, 35, 35, 34, 34, 34, 34, 47, 47, 35, 35, 34, 34, 34, 34, 47, 47, 35, 35, 34, 34, 34, 34, 47, 47, 35, 35, 34, 34, 34, 34, 47, 47, 35, 35, 34, 34, 34, 34, 47, 47]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, false]]}, "positions": {"__ndarray__": [[48, 3], "float64", [0.06491433, 0.19351249, 7.53755471, 2.40491558, 8.20153313, 10.98651072, 3.32240232, 4.98908036, 7.85486143, -0.09484622, 3.20687619, 11.00509014, 4.70376007, 4.83936587, 9.87973798, 2.20327456, 2.82883885, 7.90326309, 4.13913328, 0.85346487, 8.83562843, 1.61027721, 6.60227795, 9.01844393, -0.26573728, 7.82868642, 7.52111229, 2.98363229, 16.14534049, 10.82816371, 2.9704697, 13.21049391, 8.08725092, 0.42242453, 11.1751614, 10.1414274, 4.69263037, 13.27856114, 9.9376612, 2.0227062, 11.1350329, 8.17078842, 3.91801882, 9.43607631, 9.20093967, 1.22252037, 14.98978962, 9.17938735, 5.64855494, 0.062226, 6.84198483, 7.51468698, 8.428579, 10.77064307, 8.42362897, 5.08735845, 8.02783747, 5.82179199, 2.81891325, 9.82366054, 10.01452951, 5.06912535, 10.00857447, 7.47309138, 2.97251254, 7.95355727, 9.27715745, 1.2598723, 8.94115943, 6.58261654, 6.66744057, 9.07863963, 4.69776639, 7.64327353, 7.33990568, 7.96456322, 16.25626299, 10.68657306, 8.31606232, 13.3287484, 8.02217444, 5.73075426, 11.19786829, 9.93696862, 9.94053932, 13.35984691, 9.96831164, 7.39347082, 11.24535963, 8.00810875, 9.24217935, 9.52588418, 9.03217616, 6.35606472, 15.06320455, 8.90712436, 10.90237166, 0.11003374, 7.19997766, 12.62385477, 8.49973829, 10.93410952, 13.72692182, 5.12870957, 8.2140938, 11.00227983, 3.01598615, 10.05866883, 15.33172422, 5.28414445, 10.23607942, 12.82096064, 3.01968531, 8.26830673, 14.58472605, 1.42561799, 9.52345622, 11.86148083, 6.81010658, 9.03860402, 10.24474994, 7.91878247, 7.20847921, 13.44214772, 15.99808382, 11.00190192, 13.66492568, 13.30102984, 8.20062358, 10.95136807, 11.27191025, 10.04240533, 15.28349401, 13.27861113, 10.16042469, 12.66232707, 11.25583004, 8.1630357, 14.43520351, 9.4767648, 9.24704774, 11.79299021, 15.07304843, 9.13716946]]}, "stress": {"__ndarray__": [[6], "float64", [2.7218936770611134e-05, 0.00015171021626186586, -4.424052257866043e-05, 1.316854801617184e-06, -2.3555322242344568e-06, 8.732918309155169e-06]]}, "tags": {"__ndarray__": [[48], "int32", [0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]]}, "unique_id": "35c64dfc9717921cd8e15e0ffd73846a", "user": "cmr"}, "ids": [1], "nextid": 2}