{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=total_magnetization&page=12145","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=total_magnetization&page=12143","results":[{"id":"mp-1193516","created_at":"2022-09-04T14:40:23.316634Z","structure_string":"Eu12 Sn8 Pd8\n1.0\n6.011944 0.000000 0.000000\n0.000000 8.812027 0.000000\n0.000000 0.000000 14.095126\nEu Sn Pd\n12 8 8\ndirect\n0.145905 0.392881 0.598379 Eu\n0.854095 0.607119 0.098379 Eu\n0.145905 0.107119 0.401621 Eu\n0.854095 0.892881 0.901621 Eu\n0.854095 0.607119 0.401621 Eu\n0.145905 0.392881 0.901621 Eu\n0.854095 0.892881 0.598379 Eu\n0.145905 0.107119 0.098379 Eu\n0.646401 0.250548 0.750000 Eu\n0.353599 0.749452 0.250000 Eu\n0.646401 0.249452 0.250000 Eu\n0.353599 0.750548 0.750000 Eu\n0.643205 0.250000 0.500000 Sn\n0.356795 0.750000 0.000000 Sn\n0.356795 0.750000 0.500000 Sn\n0.643205 0.250000 0.000000 Sn\n0.149950 0.102139 0.750000 Sn\n0.850050 0.897861 0.250000 Sn\n0.149950 0.397861 0.250000 Sn\n0.850050 0.602139 0.750000 Sn\n0.381027 0.032401 0.588724 Pd\n0.618973 0.967599 0.088724 Pd\n0.381027 0.467599 0.411276 Pd\n0.618973 0.532401 0.911276 Pd\n0.618973 0.967599 0.411276 Pd\n0.381027 0.032401 0.911276 Pd\n0.618973 0.532401 0.588724 Pd\n0.381027 0.467599 0.088724 Pd\n","nsites":28,"nelements":3,"elements":["Eu","Sn","Pd"],"chemical_system":"Eu-Pd-Sn","density":8.060285664446472,"density_atomic":0.03749715544160015,"volume":746.7233092816475,"volume_molar":16.06026027595391,"formula_full":"Eu12 Sn8 Pd8","formula_reduced":"Eu3(SnPd)2","formula_anonymous":"A2B2C3","energy":-218.83305426,"energy_per_atom":-7.815466223571429,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-218.83305426,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":84.0370157,"is_theoretical":false,"updated_at":"2021-11-28T01:34:50.958000Z","spacegroup":57},{"id":"mp-647096","created_at":"2022-09-04T14:42:25.523745Z","structure_string":"Gd12 S12 N4\n1.0\n3.891300 0.000000 0.000000\n0.000000 12.015838 0.000000\n0.000000 0.000000 12.909000\nGd S N\n12 12 4\ndirect\n0.750000 0.216839 0.637851 Gd\n0.250000 0.954878 0.644494 Gd\n0.250000 0.454878 0.855506 Gd\n0.750000 0.573128 0.629658 Gd\n0.250000 0.783161 0.362149 Gd\n0.250000 0.283161 0.137851 Gd\n0.750000 0.045122 0.355506 Gd\n0.750000 0.716839 0.862149 Gd\n0.750000 0.545122 0.144494 Gd\n0.250000 0.926872 0.129658 Gd\n0.750000 0.073128 0.870342 Gd\n0.250000 0.426872 0.370342 Gd\n0.250000 0.635290 0.993435 S\n0.250000 0.727044 0.694000 S\n0.750000 0.864710 0.493435 S\n0.250000 0.227044 0.806000 S\n0.250000 0.910437 0.898594 S\n0.750000 0.772956 0.194000 S\n0.250000 0.135290 0.506565 S\n0.750000 0.272956 0.306000 S\n0.750000 0.364710 0.006565 S\n0.750000 0.589563 0.398594 S\n0.750000 0.089563 0.101406 S\n0.250000 0.410437 0.601406 S\n0.250000 0.459891 0.202200 N\n0.250000 0.959891 0.297800 N\n0.750000 0.540109 0.797800 N\n0.750000 0.040109 0.702200 N\n","nsites":28,"nelements":3,"elements":["Gd","S","N"],"chemical_system":"Gd-N-S","density":6.404049065625418,"density_atomic":0.046389175329033756,"volume":603.5890873549447,"volume_molar":12.98178016161219,"formula_full":"Gd12 S12 N4","formula_reduced":"Gd3S3N","formula_anonymous":"AB3C3","energy":-315.08303096000003,"energy_per_atom":-11.252965391428573,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-307.60303096,"band_gap":0.8742000000000001,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":84.0916254,"is_theoretical":false,"updated_at":"2021-11-28T01:35:48.078000Z","spacegroup":62},{"id":"mp-1204415","created_at":"2022-09-04T14:46:53.007198Z","structure_string":"Mn20 As8 O48\n1.0\n5.651461 0.000000 0.000000\n0.000000 9.065001 0.000000\n0.000000 0.000000 17.954414\nMn As O\n20 8 48\ndirect\n0.780509 0.778929 0.566035 Mn\n0.219491 0.278929 0.933965 Mn\n0.719491 0.221071 0.066035 Mn\n0.280509 0.721071 0.433965 Mn\n0.554062 0.626803 0.972799 Mn\n0.445938 0.126803 0.527201 Mn\n0.945938 0.373197 0.472799 Mn\n0.054062 0.873197 0.027201 Mn\n0.560472 0.647610 0.786096 Mn\n0.439528 0.147610 0.713904 Mn\n0.939528 0.352390 0.286096 Mn\n0.060472 0.852390 0.213904 Mn\n0.057711 0.627278 0.877440 Mn\n0.942289 0.127278 0.622560 Mn\n0.442289 0.372722 0.377440 Mn\n0.557711 0.872722 0.122560 Mn\n0.097278 0.459320 0.703140 Mn\n0.902722 0.959320 0.796860 Mn\n0.402722 0.540680 0.203140 Mn\n0.597278 0.040680 0.296860 Mn\n0.604376 0.450181 0.626280 As\n0.395624 0.950181 0.873720 As\n0.895624 0.549819 0.126280 As\n0.104376 0.049819 0.373720 As\n0.686022 0.316085 0.874399 As\n0.313978 0.816085 0.625601 As\n0.813978 0.683915 0.374399 As\n0.186022 0.183915 0.125601 As\n0.247260 0.496005 0.940135 O\n0.752740 0.996005 0.559865 O\n0.252740 0.503995 0.440135 O\n0.747260 0.003995 0.059865 O\n0.864338 0.747748 0.807713 O\n0.135662 0.247748 0.692287 O\n0.635662 0.252252 0.307713 O\n0.364338 0.752252 0.192287 O\n0.894829 0.722454 0.964341 O\n0.105171 0.222454 0.535659 O\n0.605171 0.277546 0.464341 O\n0.394829 0.777546 0.035659 O\n0.241302 0.564153 0.784964 O\n0.758698 0.064153 0.715036 O\n0.258698 0.435847 0.284964 O\n0.741302 0.935847 0.215036 O\n0.964905 0.256237 0.857723 O\n0.035095 0.756237 0.642277 O\n0.535095 0.743763 0.357723 O\n0.464905 0.243763 0.142277 O\n0.709192 0.509720 0.878270 O\n0.290808 0.009720 0.621730 O\n0.790808 0.490280 0.378270 O\n0.209192 0.990280 0.121730 O\n0.462665 0.266157 0.815878 O\n0.537335 0.766157 0.684122 O\n0.037335 0.733843 0.315878 O\n0.962665 0.233843 0.184122 O\n0.569864 0.267148 0.960987 O\n0.430136 0.767148 0.539013 O\n0.930136 0.732852 0.460987 O\n0.069864 0.232852 0.039013 O\n0.605811 0.258164 0.621757 O\n0.394189 0.758164 0.878243 O\n0.894189 0.741836 0.121757 O\n0.105811 0.241836 0.378243 O\n0.732290 0.482852 0.713876 O\n0.267710 0.982852 0.786124 O\n0.767710 0.517148 0.213876 O\n0.232290 0.017148 0.286124 O\n0.790099 0.528525 0.562232 O\n0.209901 0.028525 0.937768 O\n0.709901 0.471475 0.062232 O\n0.290099 0.971475 0.437768 O\n0.319244 0.508210 0.621118 O\n0.680756 0.008210 0.878882 O\n0.180756 0.491790 0.121118 O\n0.819244 0.991790 0.378882 O\n","nsites":76,"nelements":3,"elements":["Mn","As","O"],"chemical_system":"As-Mn-O","density":4.452058037441662,"density_atomic":0.08262543632529795,"volume":919.8135995407821,"volume_molar":7.288482854469554,"formula_full":"Mn20 As8 O48","formula_reduced":"Mn5(AsO6)2","formula_anonymous":"A2B5C12","energy":-596.81667464,"energy_per_atom":-7.852850982105263,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-530.48067464,"band_gap":0.0104000000000001,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":84.2122409,"is_theoretical":false,"updated_at":"2021-11-28T01:37:39.181000Z","spacegroup":19},{"id":"mp-1201532","created_at":"2022-09-04T14:42:40.599396Z","structure_string":"Eu12 Mg20 Ge20\n1.0\n4.528042 0.000000 0.000000\n0.000000 14.536226 0.000000\n0.000000 0.000000 18.432766\nEu Mg Ge\n12 20 20\ndirect\n0.250000 0.412263 0.653637 Eu\n0.250000 0.912263 0.846363 Eu\n0.750000 0.587737 0.346363 Eu\n0.750000 0.087737 0.153637 Eu\n0.250000 0.208408 0.487361 Eu\n0.250000 0.708408 0.012639 Eu\n0.750000 0.791592 0.512639 Eu\n0.750000 0.291592 0.987361 Eu\n0.250000 0.135814 0.692006 Eu\n0.250000 0.635814 0.807994 Eu\n0.750000 0.864186 0.307994 Eu\n0.750000 0.364186 0.192006 Eu\n0.250000 0.447099 0.456518 Mg\n0.250000 0.947099 0.043482 Mg\n0.750000 0.552901 0.543482 Mg\n0.750000 0.052901 0.956518 Mg\n0.250000 0.164587 0.871060 Mg\n0.250000 0.664587 0.628940 Mg\n0.750000 0.835413 0.128940 Mg\n0.750000 0.335413 0.371060 Mg\n0.250000 0.976881 0.561510 Mg\n0.250000 0.476881 0.938490 Mg\n0.750000 0.023119 0.438490 Mg\n0.750000 0.523119 0.061510 Mg\n0.250000 0.037060 0.310559 Mg\n0.250000 0.537060 0.189441 Mg\n0.750000 0.962940 0.689441 Mg\n0.750000 0.462940 0.810559 Mg\n0.250000 0.234042 0.274110 Mg\n0.250000 0.734042 0.225890 Mg\n0.750000 0.765958 0.725890 Mg\n0.750000 0.265958 0.774110 Mg\n0.250000 0.132014 0.016077 Ge\n0.250000 0.632014 0.483923 Ge\n0.750000 0.867986 0.983923 Ge\n0.750000 0.367986 0.516077 Ge\n0.250000 0.350313 0.825684 Ge\n0.250000 0.850313 0.674316 Ge\n0.750000 0.649687 0.174316 Ge\n0.750000 0.149687 0.325684 Ge\n0.250000 0.743623 0.378865 Ge\n0.250000 0.243623 0.121135 Ge\n0.750000 0.256377 0.621135 Ge\n0.750000 0.756377 0.878865 Ge\n0.250000 0.421447 0.309448 Ge\n0.250000 0.921447 0.190552 Ge\n0.750000 0.578553 0.690552 Ge\n0.750000 0.078553 0.809448 Ge\n0.250000 0.912966 0.424661 Ge\n0.250000 0.412966 0.075339 Ge\n0.750000 0.087034 0.575339 Ge\n0.750000 0.587034 0.924661 Ge\n","nsites":52,"nelements":3,"elements":["Eu","Mg","Ge"],"chemical_system":"Eu-Ge-Mg","density":5.149550121134988,"density_atomic":0.042859857304436165,"volume":1213.2564891814932,"volume_molar":14.050771838143017,"formula_full":"Eu12 Mg20 Ge20","formula_reduced":"Eu3(MgGe)5","formula_anonymous":"A3B5C5","energy":-274.19686428,"energy_per_atom":-5.273016620769231,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-274.19686428,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":84.2244791,"is_theoretical":false,"updated_at":"2021-11-28T01:36:03.052000Z","spacegroup":62},{"id":"mp-28133","created_at":"2022-09-04T14:40:54.930197Z","structure_string":"Gd12 C4 Cl12\n1.0\n-5.419093 5.419093 5.419093\n5.419093 -5.419093 5.419093\n5.419093 5.419093 -5.419093\nGd C Cl\n12 4 12\ndirect\n0.482295 0.750000 0.017705 Gd\n0.750000 0.232295 0.267705 Gd\n0.232295 0.267705 0.750000 Gd\n0.464591 0.482295 0.232295 Gd\n0.267705 0.017705 0.035409 Gd\n0.232295 0.464591 0.482295 Gd\n0.017705 0.035409 0.267705 Gd\n0.017705 0.482295 0.750000 Gd\n0.482295 0.232295 0.464591 Gd\n0.750000 0.017705 0.482295 Gd\n0.035409 0.267705 0.017705 Gd\n0.267705 0.750000 0.232295 Gd\n0.250000 0.250000 0.250000 C\n0.000000 0.250000 0.500000 C\n0.250000 0.500000 0.000000 C\n0.500000 0.000000 0.250000 C\n0.993128 0.986257 0.743128 Cl\n0.756872 0.743128 0.250000 Cl\n0.986257 0.743128 0.993128 Cl\n0.250000 0.993128 0.506872 Cl\n0.743128 0.993128 0.986257 Cl\n0.506872 0.250000 0.993128 Cl\n0.743128 0.250000 0.756872 Cl\n0.506872 0.756872 0.513743 Cl\n0.756872 0.513743 0.506872 Cl\n0.250000 0.756872 0.743128 Cl\n0.513743 0.506872 0.756872 Cl\n0.993128 0.506872 0.250000 Cl\n","nsites":28,"nelements":3,"elements":["Gd","C","Cl"],"chemical_system":"C-Cl-Gd","density":6.157570567874456,"density_atomic":0.04398638055725209,"volume":636.5606727645065,"volume_molar":13.690921334529131,"formula_full":"Gd12 C4 Cl12","formula_reduced":"Gd3CCl3","formula_anonymous":"AB3C3","energy":-278.60393553,"energy_per_atom":-9.950140554642857,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-271.23593553,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":84.2362474,"is_theoretical":false,"updated_at":"2021-11-28T01:34:59.201000Z","spacegroup":214},{"id":"mp-1199980","created_at":"2022-09-04T14:42:23.347019Z","structure_string":"Eu12 Mg20 Si20\n1.0\n4.478247 0.000000 0.000000\n0.000000 14.224976 0.000000\n0.000000 0.000000 18.136320\nEu Mg Si\n12 20 20\ndirect\n0.250000 0.412389 0.653017 Eu\n0.250000 0.912389 0.846983 Eu\n0.750000 0.587611 0.346983 Eu\n0.750000 0.087611 0.153017 Eu\n0.250000 0.208197 0.484167 Eu\n0.250000 0.708197 0.015833 Eu\n0.750000 0.791803 0.515833 Eu\n0.750000 0.291803 0.984167 Eu\n0.250000 0.136728 0.691991 Eu\n0.250000 0.636728 0.808009 Eu\n0.750000 0.863272 0.308009 Eu\n0.750000 0.363272 0.191991 Eu\n0.250000 0.446594 0.456841 Mg\n0.250000 0.946594 0.043159 Mg\n0.750000 0.553406 0.543159 Mg\n0.750000 0.053406 0.956841 Mg\n0.250000 0.164647 0.870970 Mg\n0.250000 0.664647 0.629030 Mg\n0.750000 0.835353 0.129030 Mg\n0.750000 0.335353 0.370970 Mg\n0.250000 0.978388 0.560976 Mg\n0.250000 0.478388 0.939024 Mg\n0.750000 0.021612 0.439024 Mg\n0.750000 0.521612 0.060976 Mg\n0.250000 0.034609 0.310579 Mg\n0.250000 0.534609 0.189421 Mg\n0.750000 0.965391 0.689421 Mg\n0.750000 0.465391 0.810579 Mg\n0.250000 0.232831 0.271064 Mg\n0.250000 0.732831 0.228936 Mg\n0.750000 0.767169 0.728936 Mg\n0.750000 0.267169 0.771064 Mg\n0.250000 0.134350 0.018410 Si\n0.250000 0.634350 0.481590 Si\n0.750000 0.865650 0.981590 Si\n0.750000 0.365650 0.518410 Si\n0.250000 0.351655 0.825875 Si\n0.250000 0.851655 0.674125 Si\n0.750000 0.648345 0.174125 Si\n0.750000 0.148345 0.325875 Si\n0.250000 0.746287 0.384332 Si\n0.250000 0.246287 0.115668 Si\n0.750000 0.253713 0.615668 Si\n0.750000 0.753713 0.884332 Si\n0.250000 0.418698 0.309716 Si\n0.250000 0.918698 0.190284 Si\n0.750000 0.581302 0.690284 Si\n0.750000 0.081302 0.809716 Si\n0.250000 0.908014 0.424805 Si\n0.250000 0.408014 0.075195 Si\n0.750000 0.091986 0.575195 Si\n0.750000 0.591986 0.924805 Si\n","nsites":52,"nelements":3,"elements":["Eu","Mg","Si"],"chemical_system":"Eu-Mg-Si","density":4.126964281512022,"density_atomic":0.045008505004008936,"volume":1155.3371967224489,"volume_molar":13.38000619985846,"formula_full":"Eu12 Mg20 Si20","formula_reduced":"Eu3(MgSi)5","formula_anonymous":"A3B5C5","energy":-283.49240233,"energy_per_atom":-5.451776967884616,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-284.91240233,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":84.257324,"is_theoretical":false,"updated_at":"2021-11-28T01:35:48.674000Z","spacegroup":62},{"id":"mp-1199837","created_at":"2022-09-04T14:41:28.869289Z","structure_string":"Eu12 Si8 As16\n1.0\n17.967669 0.000000 0.000000\n0.000000 7.356487 0.000000\n0.000000 2.742307 6.983059\nEu Si As\n12 8 16\ndirect\n0.315044 0.486850 0.224197 Eu\n0.815044 0.013150 0.775803 Eu\n0.684956 0.513150 0.775803 Eu\n0.184956 0.986850 0.224197 Eu\n0.063179 0.489373 0.252169 Eu\n0.563179 0.010627 0.747831 Eu\n0.936821 0.510627 0.747831 Eu\n0.436821 0.989373 0.252169 Eu\n0.558661 0.500183 0.259116 Eu\n0.058661 0.999817 0.740884 Eu\n0.441339 0.499817 0.740884 Eu\n0.941339 0.000183 0.259116 Eu\n0.870669 0.470579 0.211031 Si\n0.370669 0.029421 0.788969 Si\n0.129331 0.529421 0.788969 Si\n0.629331 0.970579 0.211031 Si\n0.740147 0.082516 0.312772 Si\n0.240147 0.417484 0.687228 Si\n0.259853 0.917484 0.687228 Si\n0.759853 0.582516 0.312772 Si\n0.561398 0.246128 0.010097 As\n0.061398 0.253872 0.989903 As\n0.438602 0.753872 0.989903 As\n0.938602 0.746128 0.010097 As\n0.812846 0.276902 0.038447 As\n0.312846 0.223098 0.961553 As\n0.187154 0.723098 0.961553 As\n0.687154 0.776902 0.038447 As\n0.932345 0.262383 0.494415 As\n0.432345 0.237617 0.505585 As\n0.067655 0.737617 0.505585 As\n0.567655 0.762383 0.494415 As\n0.696752 0.275582 0.497764 As\n0.196752 0.224418 0.502236 As\n0.303248 0.724418 0.502236 As\n0.803248 0.775582 0.497764 As\n","nsites":36,"nelements":3,"elements":["Eu","Si","As"],"chemical_system":"As-Eu-Si","density":5.841483353122251,"density_atomic":0.03900269160737322,"volume":923.0132207899832,"volume_molar":15.440320941495102,"formula_full":"Eu12 Si8 As16","formula_reduced":"Eu3(SiAs2)2","formula_anonymous":"A2B3C4","energy":-271.58461045,"energy_per_atom":-7.544016956944445,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-271.58461045,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":84.3100542,"is_theoretical":false,"updated_at":"2021-11-28T01:35:21.159000Z","spacegroup":14},{"id":"mp-1212738","created_at":"2022-09-04T14:40:08.036828Z","structure_string":"Gd12 Si4 Br12\n1.0\n-5.910554 5.910554 5.910554\n5.910554 -5.910554 5.910554\n5.910554 5.910554 -5.910554\nGd Si Br\n12 4 12\ndirect\n0.474031 0.487015 0.237015 Gd\n0.750000 0.237015 0.262985 Gd\n0.750000 0.012985 0.487015 Gd\n0.237015 0.474031 0.487015 Gd\n0.262985 0.750000 0.237015 Gd\n0.025969 0.262985 0.012985 Gd\n0.012985 0.025969 0.262985 Gd\n0.487015 0.750000 0.012985 Gd\n0.487015 0.237015 0.474031 Gd\n0.012985 0.487015 0.750000 Gd\n0.262985 0.012985 0.025969 Gd\n0.237015 0.262985 0.750000 Gd\n0.250000 0.250000 0.250000 Si\n0.500000 0.000000 0.250000 Si\n0.000000 0.250000 0.500000 Si\n0.250000 0.500000 0.000000 Si\n0.250000 0.754714 0.745286 Br\n0.509427 0.504714 0.754714 Br\n0.990572 0.745286 0.995286 Br\n0.745286 0.250000 0.754714 Br\n0.995286 0.990572 0.745286 Br\n0.250000 0.995286 0.504714 Br\n0.754714 0.509427 0.504714 Br\n0.504714 0.250000 0.995286 Br\n0.754714 0.745286 0.250000 Br\n0.745286 0.995286 0.990573 Br\n0.995286 0.504714 0.250000 Br\n0.504714 0.754714 0.509427 Br\n","nsites":28,"nelements":3,"elements":["Gd","Si","Br"],"chemical_system":"Br-Gd-Si","density":5.947447297664547,"density_atomic":0.033901075131910284,"volume":825.932507775963,"volume_molar":17.763863643166587,"formula_full":"Gd12 Si4 Br12","formula_reduced":"Gd3SiBr3","formula_anonymous":"AB3C3","energy":-256.63783145,"energy_per_atom":-9.165636837500001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-250.22983145,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":84.3728754,"is_theoretical":true,"updated_at":"2021-11-28T01:34:48.754000Z","spacegroup":214},{"id":"mp-1213266","created_at":"2022-09-04T14:47:57.069119Z","structure_string":"Gd12 Co6 Pb1\n1.0\n-4.917244 4.917244 4.917244\n4.917244 -4.917244 4.917244\n4.917244 4.917244 -4.917244\nGd Co Pb\n12 6 1\ndirect\n0.807042 0.693676 0.500719 Gd\n0.192958 0.306324 0.499281 Gd\n0.192958 0.693676 0.886634 Gd\n0.807042 0.306324 0.113366 Gd\n0.693676 0.500719 0.807042 Gd\n0.306324 0.499281 0.192958 Gd\n0.693676 0.886634 0.192958 Gd\n0.306324 0.113366 0.807042 Gd\n0.500719 0.807042 0.693676 Gd\n0.499281 0.192958 0.306324 Gd\n0.113366 0.807042 0.306324 Gd\n0.886634 0.192958 0.693676 Gd\n0.886853 0.386853 0.500000 Co\n0.113147 0.613147 0.500000 Co\n0.386853 0.500000 0.886853 Co\n0.613147 0.500000 0.113147 Co\n0.500000 0.886853 0.386853 Co\n0.500000 0.113147 0.613147 Co\n0.000000 0.000000 0.000000 Pb\n","nsites":19,"nelements":3,"elements":["Gd","Co","Pb"],"chemical_system":"Co-Gd-Pb","density":8.546722673781314,"density_atomic":0.03995106236283458,"volume":475.58184629591227,"volume_molar":15.073793796287728,"formula_full":"Gd12 Co6 Pb1","formula_reduced":"Gd12Co6Pb","formula_anonymous":"AB6C12","energy":-220.0009622,"energy_per_atom":-11.578998010526316,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-220.0009622,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":84.5435307,"is_theoretical":true,"updated_at":"2021-11-28T01:38:17.654000Z","spacegroup":204},{"id":"mp-1198083","created_at":"2022-09-04T14:42:03.633773Z","structure_string":"Gd20 Ge16\n1.0\n7.737264 0.000000 0.000000\n0.000000 7.838966 0.000000\n0.000000 0.000000 14.933136\nGd Ge\n20 16\ndirect\n0.475901 0.321797 0.900194 Gd\n0.975901 0.178203 0.599806 Gd\n0.524099 0.678203 0.400194 Gd\n0.024099 0.821797 0.099806 Gd\n0.524099 0.678203 0.099806 Gd\n0.024099 0.821797 0.400194 Gd\n0.475901 0.321797 0.599806 Gd\n0.975901 0.178203 0.900194 Gd\n0.122637 0.661887 0.883265 Gd\n0.622637 0.838113 0.616735 Gd\n0.877363 0.338113 0.383265 Gd\n0.377363 0.161887 0.116735 Gd\n0.877363 0.338113 0.116735 Gd\n0.377363 0.161887 0.383265 Gd\n0.122637 0.661887 0.616735 Gd\n0.622637 0.838113 0.883265 Gd\n0.709273 0.000616 0.250000 Gd\n0.209273 0.499384 0.250000 Gd\n0.290727 0.999384 0.750000 Gd\n0.790727 0.500616 0.750000 Gd\n0.282144 0.967103 0.955892 Ge\n0.782144 0.532897 0.544108 Ge\n0.717856 0.032897 0.455892 Ge\n0.217856 0.467103 0.044108 Ge\n0.717856 0.032897 0.044108 Ge\n0.217856 0.467103 0.455892 Ge\n0.282144 0.967103 0.544108 Ge\n0.782144 0.532897 0.955892 Ge\n0.582286 0.387416 0.250000 Ge\n0.082286 0.112584 0.250000 Ge\n0.417714 0.612584 0.750000 Ge\n0.917714 0.887416 0.750000 Ge\n0.825438 0.633532 0.250000 Ge\n0.325438 0.866468 0.250000 Ge\n0.174562 0.366468 0.750000 Ge\n0.674562 0.133532 0.750000 Ge\n","nsites":36,"nelements":2,"elements":["Gd","Ge"],"chemical_system":"Gd-Ge","density":7.896796605658388,"density_atomic":0.039747085052998496,"volume":905.7267961159376,"volume_molar":15.151150711983327,"formula_full":"Gd20 Ge16","formula_reduced":"Gd5Ge4","formula_anonymous":"A4B5","energy":-385.77259881,"energy_per_atom":-10.7159055225,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-385.77259881,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":84.8189549,"is_theoretical":false,"updated_at":"2021-11-28T01:35:30.564000Z","spacegroup":62},{"id":"mp-775739","created_at":"2022-09-04T14:41:29.648249Z","structure_string":"Li1 Mn28 O56\n1.0\n6.519528 -7.713854 0.000000\n6.519528 7.713854 0.000000\n-2.607443 0.000000 9.757511\nLi Mn O\n1 28 56\ndirect\n0.482165 0.482165 0.482165 Li\n0.642783 0.000445 0.428630 Mn\n0.999665 0.428228 0.142508 Mn\n0.928594 0.142597 0.999946 Mn\n0.715617 0.285405 0.572216 Mn\n0.857497 0.857315 0.356944 Mn\n0.857315 0.356944 0.857497 Mn\n0.715230 0.787149 0.571424 Mn\n0.427854 0.141455 0.500285 Mn\n0.999946 0.928594 0.142597 Mn\n0.000445 0.428630 0.642783 Mn\n0.571713 0.213399 0.284433 Mn\n0.714658 0.285566 0.071218 Mn\n0.857209 0.857209 0.857209 Mn\n0.142508 0.999665 0.428228 Mn\n0.572216 0.715617 0.285405 Mn\n0.213399 0.284433 0.571713 Mn\n0.787149 0.571424 0.715230 Mn\n0.428228 0.142508 0.999665 Mn\n0.500285 0.427854 0.141455 Mn\n0.571424 0.715230 0.787149 Mn\n0.142597 0.999946 0.928594 Mn\n0.141455 0.500285 0.427854 Mn\n0.285566 0.071218 0.714658 Mn\n0.284433 0.571713 0.213399 Mn\n0.428630 0.642783 0.000445 Mn\n0.285405 0.572216 0.715617 Mn\n0.356944 0.857497 0.857315 Mn\n0.071218 0.714658 0.285566 Mn\n0.970454 0.016811 0.319365 O\n0.807001 0.949852 0.521397 O\n0.840272 0.966360 0.029438 O\n0.966360 0.029438 0.840272 O\n0.982850 0.537762 0.315346 O\n0.823427 0.457909 0.554819 O\n0.605022 0.113483 0.588240 O\n0.890761 0.256337 0.159727 O\n0.731061 0.176367 0.399175 O\n0.541311 0.304666 0.462442 O\n0.478981 0.050466 0.336195 O\n0.764522 0.193280 0.907559 O\n0.620226 0.620226 0.620226 O\n0.827791 0.445457 0.033688 O\n0.907559 0.764522 0.193280 O\n0.600979 0.125618 0.109341 O\n0.315346 0.982850 0.537762 O\n0.743531 0.697660 0.395032 O\n0.663630 0.378002 0.235211 O\n0.949852 0.521397 0.807001 O\n0.886588 0.268446 0.680522 O\n0.412013 0.252247 0.172315 O\n0.537762 0.315346 0.982850 O\n0.125618 0.109341 0.600979 O\n0.554819 0.823427 0.457909 O\n0.680522 0.886588 0.268446 O\n0.252247 0.172315 0.412013 O\n0.697660 0.395032 0.743531 O\n0.747854 0.684802 0.873905 O\n0.873905 0.747854 0.684802 O\n0.319365 0.970454 0.016811 O\n0.445457 0.033688 0.827791 O\n0.588240 0.605022 0.113483 O\n0.462442 0.541311 0.304666 O\n0.304666 0.462442 0.541311 O\n0.684802 0.873905 0.747854 O\n0.256337 0.159727 0.890761 O\n0.336195 0.478981 0.050466 O\n0.399175 0.731061 0.176367 O\n0.050466 0.336195 0.478981 O\n0.113483 0.588240 0.605022 O\n0.521397 0.807001 0.949852 O\n0.235211 0.663630 0.378002 O\n0.378002 0.235211 0.663630 O\n0.092464 0.092464 0.092464 O\n0.172315 0.412013 0.252247 O\n0.457909 0.554819 0.823427 O\n0.109341 0.600979 0.125618 O\n0.268446 0.680522 0.886588 O\n0.395032 0.743531 0.697660 O\n0.033688 0.827791 0.445457 O\n0.016811 0.319365 0.970454 O\n0.159727 0.890761 0.256337 O\n0.176367 0.399175 0.731061 O\n0.193280 0.907559 0.764522 O\n0.029438 0.840272 0.966360 O\n","nsites":85,"nelements":3,"elements":["Li","Mn","O"],"chemical_system":"Li-Mn-O","density":4.1303892343415844,"density_atomic":0.08660885775150812,"volume":981.4238659500148,"volume_molar":6.9532619599698355,"formula_full":"Li1 Mn28 O56","formula_reduced":"LiMn28O56","formula_anonymous":"AB28C56","energy":-688.0452165400001,"energy_per_atom":-8.094649606352942,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-602.86921654,"band_gap":1.3066,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":85.0198879,"is_theoretical":true,"updated_at":"2021-11-28T01:35:21.061000Z","spacegroup":146},{"id":"mp-771348","created_at":"2022-09-04T14:40:09.346818Z","structure_string":"Li1 Zn6 Fe17 O32\n1.0\n3.027202 5.235251 0.000000\n-3.027202 5.235251 0.000000\n0.000000 3.418109 19.628834\nLi Zn Fe O\n1 6 17 32\ndirect\n0.063060 0.063060 0.810838 Li\n0.657837 0.657837 0.029724 Zn\n0.781088 0.781088 0.155832 Zn\n0.155189 0.155189 0.532997 Zn\n0.031179 0.031179 0.406774 Zn\n0.906055 0.906055 0.281386 Zn\n0.278841 0.278841 0.658338 Zn\n0.307230 0.307230 0.065550 Fe\n0.255312 0.255312 0.248329 Fe\n0.002025 0.002025 0.996355 Fe\n0.530609 0.031108 0.406766 Fe\n0.031108 0.530609 0.406766 Fe\n0.281210 0.781220 0.155890 Fe\n0.781220 0.281210 0.155890 Fe\n0.557276 0.557276 0.314559 Fe\n0.504160 0.504160 0.500539 Fe\n0.276980 0.785511 0.658553 Fe\n0.785511 0.276980 0.658553 Fe\n0.806863 0.806863 0.563467 Fe\n0.530083 0.530083 0.903755 Fe\n0.406795 0.406795 0.783783 Fe\n0.754694 0.754694 0.749573 Fe\n0.038998 0.529701 0.903247 Fe\n0.529701 0.038998 0.903247 Fe\n0.096507 0.609881 0.214606 O\n0.609881 0.096507 0.214606 O\n0.466649 0.951010 0.095834 O\n0.951010 0.466649 0.095834 O\n0.474056 0.474056 0.096621 O\n0.723015 0.723015 0.347308 O\n0.589812 0.589812 0.214244 O\n0.222412 0.222412 0.347612 O\n0.090251 0.090251 0.213917 O\n0.973142 0.973142 0.095990 O\n0.346594 0.859147 0.466240 O\n0.859147 0.346594 0.466240 O\n0.716043 0.202342 0.346495 O\n0.202342 0.716043 0.346495 O\n0.091185 0.091185 0.709660 O\n0.840496 0.840496 0.463656 O\n0.969010 0.969010 0.598805 O\n0.469727 0.469727 0.600157 O\n0.339559 0.339559 0.465314 O\n0.583087 0.583087 0.720735 O\n0.589314 0.118450 0.722247 O\n0.118450 0.589314 0.722247 O\n0.961934 0.456426 0.597521 O\n0.237363 0.680893 0.845689 O\n0.680893 0.237363 0.845689 O\n0.456426 0.961934 0.597521 O\n0.238723 0.238723 0.844823 O\n0.344230 0.344230 0.965430 O\n0.716961 0.716961 0.849277 O\n0.838754 0.838754 0.963708 O\n0.359880 0.840101 0.962382 O\n0.840101 0.359880 0.962382 O\n","nsites":56,"nelements":4,"elements":["Li","Zn","Fe","O"],"chemical_system":"Fe-Li-O-Zn","density":4.96628421242788,"density_atomic":0.09000872690798983,"volume":622.1618938933024,"volume_molar":6.6906187509529484,"formula_full":"Li1 Zn6 Fe17 O32","formula_reduced":"LiZn6Fe17O32","formula_anonymous":"AB6C17D32","energy":-404.84906694,"energy_per_atom":-7.229447623928571,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-344.51306694,"band_gap":0.8739000000000003,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":85.044562,"is_theoretical":true,"updated_at":"2021-11-28T01:34:47.096000Z","spacegroup":8}]}