{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-energy_above_hull&page=10236","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-energy_above_hull&page=10234","results":[{"id":"mp-1389151","created_at":"2022-09-04T14:40:12.247894Z","structure_string":"Al2 Mo2 O6\n1.0\n1.631550 -2.825928 0.000000\n1.631550 2.825928 0.000000\n0.000000 0.000000 12.403619\nAl Mo O\n2 2 6\ndirect\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.666667 0.333333 0.750000 Mo\n0.333333 0.666667 0.250000 Mo\n0.333333 0.666667 0.428488 O\n0.666667 0.333333 0.928488 O\n0.666667 0.333333 0.571512 O\n0.333333 0.666667 0.071512 O\n0.000000 0.000000 0.250000 O\n0.000000 0.000000 0.750000 O\n","nsites":10,"nelements":3,"elements":["Al","Mo","O"],"chemical_system":"Al-Mo-O","density":4.962853092618609,"density_atomic":0.08742992515107582,"volume":114.37731397711198,"volume_molar":6.887962845208839,"formula_full":"Al2 Mo2 O6","formula_reduced":"AlMoO3","formula_anonymous":"ABC3","energy":-79.29805426,"energy_per_atom":-7.929805426,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-68.77205426,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.3080751,"is_theoretical":true,"updated_at":"2021-11-28T01:34:47.684000Z","spacegroup":194},{"id":"mp-1234343","created_at":"2022-09-04T14:40:12.268181Z","structure_string":"Mg1 Cr4 Hg4 H4 O18\n1.0\n5.081347 2.851508 -3.225543\n-4.969028 2.528831 3.129995\n0.608585 -0.270836 16.299807\nMg Cr Hg H O\n1 4 4 4 18\ndirect\n0.681261 0.757186 0.453240 Mg\n0.762425 0.357261 0.617195 Cr\n0.356978 0.756202 0.906544 Cr\n0.138350 0.543518 0.391779 Cr\n0.651024 0.258774 0.089430 Cr\n0.005555 0.006089 0.651424 Hg\n0.958348 0.955026 0.882920 Hg\n0.242854 0.136790 0.378169 Hg\n0.047649 0.053867 0.113153 Hg\n0.579730 0.431994 0.798178 H\n0.414621 0.560406 0.726918 H\n0.409308 0.574235 0.213732 H\n0.649283 0.536563 0.264205 H\n0.036669 0.316283 0.675014 O\n0.232644 0.970073 0.845352 O\n0.986953 0.732910 0.329315 O\n0.785233 0.058068 0.147301 O\n0.523671 0.175650 0.672894 O\n0.210948 0.525722 0.845980 O\n0.362401 0.643466 0.334699 O\n0.794554 0.487289 0.150354 O\n0.918564 0.734993 0.588426 O\n0.710512 0.969266 0.923558 O\n0.922598 0.171691 0.408912 O\n0.296818 0.035321 0.076377 O\n0.625236 0.364505 0.493493 O\n0.285006 0.587746 0.009217 O\n0.358432 0.637802 0.495320 O\n0.711948 0.429335 0.984666 O\n0.605827 0.614441 0.758765 O\n0.444603 0.427528 0.238052 O\n","nsites":31,"nelements":5,"elements":["Mg","Cr","Hg","H","O"],"chemical_system":"Cr-H-Hg-Mg-O","density":4.887182810880454,"density_atomic":0.06877144578186753,"volume":450.7684788004493,"volume_molar":8.756745901636716,"formula_full":"Mg1 Cr4 Hg4 H4 O18","formula_reduced":"MgCr4Hg4(H2O9)2","formula_anonymous":"AB4C4D4E18","energy":-186.12900107,"energy_per_atom":-6.00416132483871,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-165.76700107,"band_gap":0.7221,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.9999999,"is_theoretical":true,"updated_at":"2021-11-28T01:34:49.699000Z","spacegroup":1},{"id":"mp-770738","created_at":"2022-09-04T14:40:12.307153Z","structure_string":"Na6 B2 Sb2 As2 O14\n1.0\n7.108555 0.000000 0.000000\n0.000000 5.501842 0.000000\n0.000000 0.529984 9.539204\nNa B Sb As O\n6 2 2 2 14\ndirect\n0.250000 0.765544 0.932721 Na\n0.007565 0.248319 0.758915 Na\n0.492435 0.248319 0.758915 Na\n0.507565 0.751681 0.241085 Na\n0.992435 0.751681 0.241085 Na\n0.750000 0.234456 0.067279 Na\n0.750000 0.731921 0.937254 B\n0.250000 0.268079 0.062746 B\n0.750000 0.775037 0.664662 Sb\n0.250000 0.224963 0.335338 Sb\n0.250000 0.716611 0.598256 As\n0.750000 0.283389 0.401744 As\n0.250000 0.271733 0.923525 O\n0.750000 0.954649 0.850304 O\n0.750000 0.525751 0.855027 O\n0.063165 0.823023 0.696305 O\n0.436835 0.823023 0.696305 O\n0.250000 0.408722 0.604892 O\n0.750000 0.175448 0.576359 O\n0.250000 0.824552 0.423641 O\n0.750000 0.591278 0.395108 O\n0.563165 0.176977 0.303695 O\n0.936835 0.176977 0.303695 O\n0.250000 0.474249 0.144973 O\n0.250000 0.045351 0.149696 O\n0.750000 0.728267 0.076475 O\n","nsites":26,"nelements":5,"elements":["Na","B","Sb","As","O"],"chemical_system":"As-B-Na-O-Sb","density":3.45797028987896,"density_atomic":0.06969020936230119,"volume":373.07966553569656,"volume_molar":8.641301002114176,"formula_full":"Na6 B2 Sb2 As2 O14","formula_reduced":"Na3BSbAsO7","formula_anonymous":"ABCD3E7","energy":-163.19220104,"energy_per_atom":-6.276623116923076,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-153.57420104,"band_gap":2.7266000000000004,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0028835,"is_theoretical":true,"updated_at":"2021-11-28T01:34:51.711000Z","spacegroup":11},{"id":"mp-30651","created_at":"2022-09-04T14:40:28.170335Z","structure_string":"Mg2 Ga4\n1.0\n2.172102 -3.762192 0.000000\n2.172102 3.762192 0.000000\n0.000000 0.000000 7.065652\nMg Ga\n2 4\ndirect\n0.000000 0.000000 0.750000 Mg\n0.000000 0.000000 0.250000 Mg\n0.666667 0.333333 0.551265 Ga\n0.333333 0.666667 0.051265 Ga\n0.666667 0.333333 0.948735 Ga\n0.333333 0.666667 0.448735 Ga\n","nsites":6,"nelements":2,"elements":["Mg","Ga"],"chemical_system":"Ga-Mg","density":4.709335633335855,"density_atomic":0.05195745139846408,"volume":115.47910527761887,"volume_molar":11.590523780344661,"formula_full":"Mg2 Ga4","formula_reduced":"MgGa2","formula_anonymous":"AB2","energy":-16.06074827,"energy_per_atom":-2.6767913783333337,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-16.06074827,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0007389,"is_theoretical":false,"updated_at":"2021-11-28T01:35:04.303000Z","spacegroup":194},{"id":"mp-1216851","created_at":"2022-09-04T14:40:12.199166Z","structure_string":"V32 N3\n1.0\n0.000000 0.000000 2.988265\n8.659750 -0.050159 0.000000\n-0.100075 17.373721 0.000000\nV N\n32 3\ndirect\n0.500000 0.888317 0.056547 V\n0.500000 0.885226 0.557591 V\n0.500000 0.114774 0.442409 V\n0.500000 0.111683 0.943453 V\n0.000000 0.615521 0.308813 V\n0.000000 0.613272 0.805516 V\n0.000000 0.386728 0.194484 V\n0.000000 0.384479 0.691187 V\n0.500000 0.384769 0.063180 V\n0.500000 0.376093 0.561298 V\n0.500000 0.623907 0.438702 V\n0.500000 0.615231 0.936820 V\n0.000000 0.111209 0.316602 V\n0.000000 0.113496 0.811645 V\n0.000000 0.886504 0.188355 V\n0.000000 0.888791 0.683398 V\n0.500000 0.124144 0.193954 V\n0.500000 0.124589 0.686019 V\n0.500000 0.875411 0.313981 V\n0.500000 0.875856 0.806046 V\n0.000000 0.626780 0.057647 V\n0.000000 0.630929 0.554818 V\n0.000000 0.369071 0.445182 V\n0.000000 0.373220 0.942353 V\n0.500000 0.345359 0.329599 V\n0.500000 0.340423 0.827226 V\n0.500000 0.659577 0.172774 V\n0.500000 0.654641 0.670401 V\n0.000000 0.158671 0.079472 V\n0.000000 0.129944 0.564800 V\n0.000000 0.870056 0.435200 V\n0.000000 0.841329 0.920528 V\n0.500000 0.501501 0.250882 N\n0.500000 0.498499 0.749118 N\n0.000000 0.000000 0.000000 N\n","nsites":35,"nelements":2,"elements":["V","N"],"chemical_system":"N-V","density":6.1761953134422445,"density_atomic":0.0778511852094873,"volume":449.57568604536465,"volume_molar":7.7354516103964395,"formula_full":"V32 N3","formula_reduced":"V32N3","formula_anonymous":"A3B32","energy":-325.43744878,"energy_per_atom":-9.298212822285715,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-324.35444878,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0041239,"is_theoretical":true,"updated_at":"2021-11-28T01:34:45.986000Z","spacegroup":10},{"id":"mp-554621","created_at":"2022-09-04T14:40:12.250225Z","structure_string":"K32 Fe16 F80\n1.0\n7.559761 0.000000 0.000000\n0.000000 13.058660 0.000000\n0.000000 0.000000 20.778143\nK Fe F\n32 16 80\ndirect\n0.677192 0.018973 0.492433 K\n0.677192 0.481027 0.992433 K\n0.014711 0.460963 0.663335 K\n0.651666 0.480769 0.506267 K\n0.667884 0.213865 0.750153 K\n0.325663 0.229053 0.584337 K\n0.814553 0.964774 0.661814 K\n0.507881 0.767744 0.082480 K\n0.151666 0.519231 0.493733 K\n0.166093 0.323549 0.250803 K\n0.151666 0.980769 0.993733 K\n0.177192 0.518973 0.007567 K\n0.825663 0.729053 0.915663 K\n0.666093 0.823549 0.249197 K\n0.814553 0.535226 0.161814 K\n0.314553 0.464774 0.838186 K\n0.007881 0.267744 0.417520 K\n0.167884 0.713865 0.749847 K\n0.507881 0.732256 0.582480 K\n0.166093 0.176451 0.750803 K\n0.014711 0.039037 0.163335 K\n0.177192 0.981027 0.507567 K\n0.651666 0.019231 0.006267 K\n0.514711 0.539037 0.336665 K\n0.325663 0.270947 0.084337 K\n0.514711 0.960963 0.836665 K\n0.666093 0.676451 0.749197 K\n0.667884 0.286135 0.250153 K\n0.167884 0.786135 0.249847 K\n0.314553 0.035226 0.338186 K\n0.007881 0.232256 0.917520 K\n0.825663 0.770947 0.415663 K\n0.493075 0.249821 0.921909 Fe\n0.328730 0.946333 0.672326 Fe\n0.332305 0.751365 0.422781 Fe\n0.500938 0.053180 0.171136 Fe\n0.500938 0.446820 0.671136 Fe\n0.832305 0.248635 0.577219 Fe\n0.000938 0.553180 0.328864 Fe\n0.332305 0.748635 0.922781 Fe\n0.493075 0.250179 0.421909 Fe\n0.828730 0.446333 0.827674 Fe\n0.993075 0.750179 0.078091 Fe\n0.828730 0.053667 0.327674 Fe\n0.832305 0.251365 0.077219 Fe\n0.993075 0.749821 0.578091 Fe\n0.328730 0.553667 0.172326 Fe\n0.000938 0.946820 0.828864 Fe\n0.472412 0.550177 0.096125 F\n0.457105 0.672584 0.202977 F\n0.990703 0.339367 0.030992 F\n0.389679 0.373449 0.960925 F\n0.846609 0.548704 0.402129 F\n0.171881 0.928434 0.752746 F\n0.163161 0.654296 0.126016 F\n0.477951 0.742290 0.347459 F\n0.834119 0.738998 0.149548 F\n0.170277 0.751228 0.502894 F\n0.869415 0.456100 0.277143 F\n0.690664 0.361105 0.109794 F\n0.841673 0.836724 0.027800 F\n0.163161 0.845704 0.626016 F\n0.957105 0.172584 0.297023 F\n0.334119 0.261002 0.850452 F\n0.624845 0.361213 0.386073 F\n0.876101 0.672418 0.296149 F\n0.876101 0.827582 0.796149 F\n0.670277 0.251228 0.997106 F\n0.941300 0.371465 0.539781 F\n0.967960 0.543544 0.778645 F\n0.190664 0.861105 0.390206 F\n0.889679 0.873449 0.539075 F\n0.341673 0.336724 0.472200 F\n0.477951 0.757710 0.847459 F\n0.170277 0.748772 0.002894 F\n0.346609 0.451296 0.597871 F\n0.124845 0.861213 0.113927 F\n0.490703 0.839367 0.469008 F\n0.441300 0.628535 0.460219 F\n0.457105 0.827416 0.702977 F\n0.674192 0.947413 0.357853 F\n0.841673 0.663276 0.527800 F\n0.671881 0.071566 0.247254 F\n0.346609 0.048704 0.097871 F\n0.663161 0.154296 0.373984 F\n0.869415 0.043900 0.777143 F\n0.376101 0.172418 0.203851 F\n0.834119 0.761002 0.649548 F\n0.190664 0.638895 0.890206 F\n0.655561 0.154335 0.120099 F\n0.652701 0.947442 0.138435 F\n0.124845 0.638787 0.613927 F\n0.472412 0.949823 0.596125 F\n0.846609 0.951296 0.902129 F\n0.467960 0.043544 0.721355 F\n0.967960 0.956456 0.278645 F\n0.889679 0.626551 0.039075 F\n0.155561 0.845665 0.879901 F\n0.655561 0.345665 0.620099 F\n0.663161 0.345704 0.873984 F\n0.670277 0.248772 0.497106 F\n0.369415 0.956100 0.222857 F\n0.467960 0.456456 0.221355 F\n0.341673 0.163276 0.972200 F\n0.334119 0.238998 0.350452 F\n0.389679 0.126551 0.460925 F\n0.652701 0.552558 0.638435 F\n0.972412 0.050177 0.403875 F\n0.174192 0.447413 0.142147 F\n0.490703 0.660633 0.969008 F\n0.171881 0.571566 0.252746 F\n0.957105 0.327416 0.797023 F\n0.674192 0.552587 0.857853 F\n0.990703 0.160633 0.530992 F\n0.671881 0.428434 0.747254 F\n0.624845 0.138787 0.886073 F\n0.977951 0.242290 0.152541 F\n0.972412 0.449823 0.903875 F\n0.941300 0.128535 0.039781 F\n0.376101 0.327582 0.703851 F\n0.441300 0.871465 0.960219 F\n0.152701 0.447442 0.361565 F\n0.690664 0.138895 0.609794 F\n0.977951 0.257710 0.652541 F\n0.155561 0.654335 0.379901 F\n0.369415 0.543900 0.722857 F\n0.152701 0.052558 0.861565 F\n0.174192 0.052587 0.642147 F\n","nsites":128,"nelements":3,"elements":["K","Fe","F"],"chemical_system":"F-Fe-K","density":2.966572038107639,"density_atomic":0.062401719734759255,"volume":2051.225519810489,"volume_molar":9.65060063343979,"formula_full":"K32 Fe16 F80","formula_reduced":"K2FeF5","formula_anonymous":"AB2C5","energy":-682.89606941,"energy_per_atom":-5.335125542265625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-609.84006941,"band_gap":3.6845,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":23.5822515,"is_theoretical":false,"updated_at":"2021-11-28T01:34:48.039000Z","spacegroup":33},{"id":"mp-14100","created_at":"2022-09-04T14:40:12.263772Z","structure_string":"Cd2 Rh4 O8\n1.0\n0.000000 4.463421 4.463421\n4.463421 0.000000 4.463421\n4.463421 4.463421 0.000000\nCd Rh O\n2 4 8\ndirect\n0.250000 0.250000 0.250000 Cd\n0.000000 0.000000 0.000000 Cd\n0.625000 0.625000 0.125000 Rh\n0.625000 0.125000 0.625000 Rh\n0.125000 0.625000 0.625000 Rh\n0.625000 0.625000 0.625000 Rh\n0.856536 0.856536 0.430393 O\n0.856536 0.430393 0.856536 O\n0.430393 0.856536 0.856536 O\n0.856536 0.856536 0.856536 O\n0.393464 0.393464 0.819607 O\n0.393464 0.819607 0.393464 O\n0.819607 0.393464 0.393464 O\n0.393464 0.393464 0.393464 O\n","nsites":14,"nelements":3,"elements":["Cd","Rh","O"],"chemical_system":"Cd-O-Rh","density":7.137703343358692,"density_atomic":0.07872170337726839,"volume":177.84168024040278,"volume_molar":7.649911652875829,"formula_full":"Cd2 Rh4 O8","formula_reduced":"Cd(RhO2)2","formula_anonymous":"AB2C4","energy":-87.87239111999999,"energy_per_atom":-6.276599365714285,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-82.37639112,"band_gap":0.8366999999999996,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":7.83e-05,"is_theoretical":false,"updated_at":"2021-11-28T01:34:50.894000Z","spacegroup":227},{"id":"mp-1186127","created_at":"2022-09-04T14:40:12.285758Z","structure_string":"Na1 Cd3\n1.0\n-2.294658 2.294658 4.520401\n2.294658 -2.294658 4.520401\n2.294658 2.294658 -4.520401\nNa Cd\n1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.750000 0.250000 0.500000 Cd\n0.250000 0.750000 0.500000 Cd\n0.500000 0.500000 0.000000 Cd\n","nsites":4,"nelements":2,"elements":["Na","Cd"],"chemical_system":"Cd-Na","density":6.282715168721077,"density_atomic":0.042013329906629246,"volume":95.20787828266961,"volume_molar":14.333881111979586,"formula_full":"Na1 Cd3","formula_reduced":"NaCd3","formula_anonymous":"AB3","energy":-4.35317719,"energy_per_atom":-1.0882942975,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-4.35317719,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0009094,"is_theoretical":true,"updated_at":"2021-11-28T01:34:46.601000Z","spacegroup":139},{"id":"mp-1229009","created_at":"2022-09-04T14:40:12.291942Z","structure_string":"As4 H10 C2 O12\n1.0\n6.332590 3.884599 0.000000\n-6.332590 3.884599 0.000000\n0.000000 0.051718 7.521247\nAs H C O\n4 10 2 12\ndirect\n0.765106 0.008523 0.043609 As\n0.504911 0.267739 0.964677 As\n0.267739 0.504911 0.464677 As\n0.008523 0.765106 0.543609 As\n0.080198 0.235982 0.949592 H\n0.730923 0.588165 0.044794 H\n0.588165 0.730923 0.544794 H\n0.235982 0.080198 0.449592 H\n0.818002 0.931636 0.335697 H\n0.437588 0.304406 0.664463 H\n0.304406 0.437588 0.164463 H\n0.931636 0.818002 0.835697 H\n0.380478 0.897933 0.084839 H\n0.897933 0.380478 0.584839 H\n0.515166 0.023333 0.028704 C\n0.023333 0.515166 0.528704 C\n0.754921 0.791468 0.963747 O\n0.288342 0.269836 0.031398 O\n0.269836 0.288342 0.531398 O\n0.791468 0.754921 0.463747 O\n0.835793 0.057998 0.265731 O\n0.556157 0.307918 0.737431 O\n0.307918 0.556157 0.237431 O\n0.057998 0.835793 0.765731 O\n0.937398 0.215346 0.922350 O\n0.716441 0.447533 0.072569 O\n0.447533 0.716441 0.572569 O\n0.215346 0.937398 0.422350 O\n","nsites":28,"nelements":4,"elements":["As","H","C","O"],"chemical_system":"As-C-H-O","density":2.3594226692653137,"density_atomic":0.07566771502980431,"volume":370.0389259669232,"volume_molar":7.95866606732868,"formula_full":"As4 H10 C2 O12","formula_reduced":"As2H5CO6","formula_anonymous":"AB2C5D6","energy":-158.79914407,"energy_per_atom":-5.6713980025,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-150.55514407,"band_gap":1.659,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.9989018,"is_theoretical":true,"updated_at":"2021-11-28T01:34:46.563000Z","spacegroup":9},{"id":"mp-580931","created_at":"2022-09-04T14:40:12.295169Z","structure_string":"Mg4 Zn20\n1.0\n2.521138 9.536974 0.000000\n-2.521138 9.536974 0.000000\n0.000000 3.438240 8.157461\nMg Zn\n4 20\ndirect\n0.280905 0.280905 0.373635 Mg\n0.719095 0.719095 0.626365 Mg\n0.466487 0.466487 0.202128 Mg\n0.533513 0.533513 0.797872 Mg\n0.500000 0.500000 0.500000 Zn\n0.035336 0.035336 0.295405 Zn\n0.210797 0.210797 0.125468 Zn\n0.123145 0.123145 0.711899 Zn\n0.876855 0.876855 0.288101 Zn\n0.122989 0.616147 0.038203 Zn\n0.119103 0.624895 0.540264 Zn\n0.964664 0.964664 0.704595 Zn\n0.746764 0.746764 0.235520 Zn\n0.375105 0.880897 0.459736 Zn\n0.624895 0.119103 0.540264 Zn\n0.880897 0.375105 0.459736 Zn\n0.383853 0.877011 0.961797 Zn\n0.789203 0.789203 0.874532 Zn\n0.616147 0.122989 0.038203 Zn\n0.877011 0.383853 0.961797 Zn\n0.000000 0.000000 0.000000 Zn\n0.387987 0.387987 0.778971 Zn\n0.612013 0.612013 0.221029 Zn\n0.253236 0.253236 0.764480 Zn\n","nsites":24,"nelements":2,"elements":["Mg","Zn"],"chemical_system":"Mg-Zn","density":5.949176144787029,"density_atomic":0.06118134537467926,"volume":392.27643414871244,"volume_molar":9.843099596976739,"formula_full":"Mg4 Zn20","formula_reduced":"MgZn5","formula_anonymous":"AB5","energy":-32.60904407,"energy_per_atom":-1.3587101695833335,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.60904407,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0031009,"is_theoretical":false,"updated_at":"2021-11-28T01:34:55.918000Z","spacegroup":12},{"id":"mp-1280637","created_at":"2022-09-04T14:40:12.296913Z","structure_string":"Li8 Mg2 Ni6 O16\n1.0\n-2.902799 5.027898 -0.000174\n-2.922491 -1.687499 4.801672\n5.738771 3.313188 4.716055\nLi Mg Ni O\n8 2 6 16\ndirect\n0.250003 0.250011 0.250011 Li\n0.750007 0.749952 0.750029 Li\n0.250012 0.749989 0.749995 Li\n0.750005 0.249987 0.250046 Li\n0.000249 0.999897 0.500045 Li\n0.499766 0.500097 0.000001 Li\n0.999771 0.499955 0.000069 Li\n0.500228 0.000026 0.500001 Li\n0.249998 0.250032 0.750011 Mg\n0.749972 0.750036 0.250007 Mg\n0.749847 0.250133 0.749966 Ni\n0.000357 0.499815 0.499915 Ni\n0.499630 0.000184 0.999991 Ni\n0.249987 0.749993 0.250097 Ni\n0.999672 0.999782 0.999973 Ni\n0.500338 0.500133 0.500041 Ni\n0.249466 0.740851 0.015693 O\n0.750512 0.240770 0.515710 O\n0.250528 0.759178 0.484282 O\n0.749539 0.259192 0.984314 O\n0.249381 0.213382 0.998785 O\n0.750622 0.713327 0.498794 O\n0.250602 0.286597 0.501199 O\n0.749371 0.786662 0.001182 O\n0.015860 0.520061 0.260763 O\n0.515657 0.020231 0.760808 O\n0.484166 0.980016 0.239174 O\n0.984380 0.479744 0.739156 O\n0.015663 0.979777 0.239160 O\n0.515904 0.479928 0.739224 O\n0.484331 0.520269 0.260799 O\n0.984177 0.019993 0.760757 O\n","nsites":32,"nelements":4,"elements":["Li","Mg","Ni","O"],"chemical_system":"Li-Mg-Ni-O","density":4.2680269102842265,"density_atomic":0.11547073077136932,"volume":277.1265045802786,"volume_molar":5.215296309091321,"formula_full":"Li8 Mg2 Ni6 O16","formula_reduced":"Li4MgNi3O8","formula_anonymous":"AB3C4D8","energy":-187.1497653,"energy_per_atom":-5.848430165625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-160.9117653,"band_gap":0.7586999999999997,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":3.9997019,"is_theoretical":true,"updated_at":"2021-11-28T01:34:49.463000Z","spacegroup":12},{"id":"mp-1043309","created_at":"2022-09-04T14:40:12.305780Z","structure_string":"Mg4 Ge8 W4 O24\n1.0\n8.518014 0.000000 0.000000\n0.000000 5.579077 0.000000\n0.000000 2.275014 12.121931\nMg Ge W O\n4 8 4 24\ndirect\n0.418517 0.538412 0.235664 Mg\n0.918517 0.961588 0.764336 Mg\n0.581483 0.461588 0.764336 Mg\n0.081483 0.038412 0.235664 Mg\n0.370186 0.152212 0.082685 Ge\n0.870186 0.347788 0.917315 Ge\n0.629814 0.847788 0.917315 Ge\n0.129814 0.652212 0.082685 Ge\n0.340794 0.787536 0.462264 Ge\n0.840794 0.712464 0.537736 Ge\n0.659206 0.212464 0.537736 Ge\n0.159206 0.287536 0.462264 Ge\n0.662098 0.014871 0.292392 W\n0.162098 0.485129 0.707608 W\n0.337902 0.985129 0.707608 W\n0.837902 0.514871 0.292392 W\n0.288214 0.531515 0.396066 O\n0.788214 0.968485 0.603934 O\n0.711786 0.468485 0.603934 O\n0.211786 0.031515 0.396066 O\n0.288267 0.842745 0.160193 O\n0.788267 0.657255 0.839807 O\n0.711733 0.157255 0.839807 O\n0.211733 0.342745 0.160193 O\n0.967083 0.337672 0.422288 O\n0.467083 0.162328 0.577712 O\n0.032917 0.662328 0.577712 O\n0.532917 0.837672 0.422288 O\n0.998828 0.717239 0.198786 O\n0.498828 0.782761 0.801214 O\n0.001172 0.282761 0.801214 O\n0.501172 0.217239 0.198786 O\n0.357517 0.303939 0.772313 O\n0.857517 0.196061 0.227687 O\n0.642483 0.696061 0.227687 O\n0.142483 0.803939 0.772313 O\n0.336506 0.702284 0.606722 O\n0.836506 0.797716 0.393278 O\n0.663494 0.297716 0.393278 O\n0.163494 0.202284 0.606722 O\n","nsites":40,"nelements":4,"elements":["Mg","Ge","W","O"],"chemical_system":"Ge-Mg-O-W","density":5.181915473083376,"density_atomic":0.0694364451628567,"volume":576.066356884828,"volume_molar":8.672881720652073,"formula_full":"Mg4 Ge8 W4 O24","formula_reduced":"MgGe2WO6","formula_anonymous":"ABC2D6","energy":-297.44416785,"energy_per_atom":-7.43610419625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-263.20416785,"band_gap":1.5448,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":7.9991961,"is_theoretical":true,"updated_at":"2021-11-28T01:34:52.861000Z","spacegroup":14}]}