{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=604","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=602","results":[{"id":"jvasp-21270","created_at":"2022-09-04T14:37:29.864224Z","updated_at":"2022-09-04T14:37:29.864256Z","structure_string":"Al4 Si4 P12\n1.0\n5.922357 -0.000000 0.000000\n0.000000 6.151006 0.000000\n0.000000 0.000000 9.971882\nAl Si P\n4 4 12\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Al\n0.500000 0.500000 0.000000 Al\n0.000000 0.000000 0.500000 Al\n0.000126 0.561936 0.750000 Si\n-0.000126 0.438065 0.250000 Si\n0.499874 0.061935 0.250000 Si\n0.500126 0.938065 0.750000 Si\n0.111450 0.085597 0.250000 P\n0.888550 0.914404 0.750000 P\n0.610939 0.892304 0.441307 P\n0.110938 0.607697 0.058693 P\n0.889062 0.392303 0.558693 P\n0.110938 0.607697 0.441307 P\n0.389062 0.107697 0.558693 P\n0.610939 0.892304 0.058693 P\n0.611451 0.414404 0.250000 P\n0.388550 0.585597 0.750000 P\n0.389062 0.107697 0.941307 P\n0.889062 0.392303 0.941307 P\n","nsites":20,"nelements":3,"elements":["Al","Si","P"],"chemical_system":"Al-P-Si","density":2.705943209957458,"density_atomic":0.05505694773086663,"volume":363.26023915756195,"volume_molar":10.93802146359051,"formula_full":"Al4 Si4 P12","formula_reduced":"AlSiP3","formula_anonymous":"ABC3","energy_above_hull":2.85450558,"spacegroup":62},{"id":"jvasp-36620","created_at":"2022-09-04T14:37:29.796448Z","updated_at":"2022-09-04T14:37:29.796475Z","structure_string":"Cd1 Os1 O3\n1.0\n3.937667 0.000000 -0.000000\n-0.000000 3.937667 0.000000\n0.000000 -0.000000 3.937667\nCd Os O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Os\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n","nsites":5,"nelements":3,"elements":["Cd","Os","O"],"chemical_system":"Cd-O-Os","density":9.536578900051948,"density_atomic":0.08189418143323052,"volume":61.054398645849716,"volume_molar":7.353563653249207,"formula_full":"Cd1 Os1 O3","formula_reduced":"CdOsO3","formula_anonymous":"ABC3","energy_above_hull":2.24678705,"spacegroup":221},{"id":"jvasp-11575","created_at":"2022-09-04T14:37:17.591019Z","updated_at":"2022-09-04T14:37:17.591044Z","structure_string":"Mn2 Al2 O6\n1.0\n1.572332 -2.723359 0.000000\n1.572332 2.723359 0.000000\n0.000000 -0.000000 11.556509\nMn Al O\n2 2 6\ndirect\n0.666667 0.333332 0.750000 Mn\n0.333332 0.666667 0.250000 Mn\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.333332 0.666667 0.422148 O\n0.666667 0.333332 0.922148 O\n0.666667 0.333332 0.577852 O\n0.333332 0.666667 0.077852 O\n0.000000 0.000000 0.250000 O\n0.000000 0.000000 0.750000 O\n","nsites":10,"nelements":3,"elements":["Mn","Al","O"],"chemical_system":"Al-Mn-O","density":4.359552282415267,"density_atomic":0.10104019933556184,"volume":98.9705094186253,"volume_molar":5.960143388078674,"formula_full":"Mn2 Al2 O6","formula_reduced":"MnAlO3","formula_anonymous":"ABC3","energy_above_hull":2.331364108275862,"spacegroup":194},{"id":"jvasp-34474","created_at":"2022-09-04T14:37:17.600338Z","updated_at":"2022-09-04T14:37:17.600370Z","structure_string":"Na1 V1 F3\n1.0\n4.091193 -0.000000 0.000000\n-0.000000 4.091193 -0.000000\n0.000000 0.000000 4.091193\nNa V F\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 V\n0.000000 0.500000 0.500000 F\n0.500000 0.000000 0.500000 F\n0.500000 0.500000 0.000000 F\n","nsites":5,"nelements":3,"elements":["Na","V","F"],"chemical_system":"F-Na-V","density":3.174875378173144,"density_atomic":0.07301634701009617,"volume":68.47781633486315,"volume_molar":8.247660978119464,"formula_full":"Na1 V1 F3","formula_reduced":"NaVF3","formula_anonymous":"ABC3","energy_above_hull":0.1531388095000001,"spacegroup":221},{"id":"jvasp-40996","created_at":"2022-09-04T14:37:32.988813Z","updated_at":"2022-09-04T14:37:32.988838Z","structure_string":"Ac1 Fe1 O3\n1.0\n3.930235 -0.000000 0.000000\n0.000000 3.930235 -0.000000\n0.000000 0.000000 3.930235\nAc Fe O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ac\n0.499999 0.499999 0.499999 Fe\n0.499999 0.499999 0.000000 O\n0.000000 0.499999 0.499999 O\n0.499999 0.000000 0.499999 O\n","nsites":5,"nelements":3,"elements":["Ac","Fe","O"],"chemical_system":"Ac-Fe-O","density":9.049315994169064,"density_atomic":0.08235964154233515,"volume":60.70934630561573,"volume_molar":7.312004578000078,"formula_full":"Ac1 Fe1 O3","formula_reduced":"AcFeO3","formula_anonymous":"ABC3","energy_above_hull":1.8989092,"spacegroup":221},{"id":"jvasp-22913","created_at":"2022-09-04T14:37:30.869390Z","updated_at":"2022-09-04T14:37:30.869408Z","structure_string":"Sr6 Ge6 O18\n1.0\n6.905969 0.003410 2.288445\n3.056843 6.192586 2.288445\n-0.020789 -0.012929 11.381826\nSr Ge O\n6 6 18\ndirect\n0.330508 0.839829 0.500659 Sr\n0.669491 0.160171 0.499343 Sr\n0.839829 0.330509 0.000658 Sr\n0.500000 -0.000000 0.000000 Sr\n-0.000000 0.500000 0.500000 Sr\n0.160171 0.669492 0.999343 Sr\n0.582222 0.679732 0.753441 Ge\n0.320268 0.417778 0.746561 Ge\n0.417778 0.320269 0.246561 Ge\n0.679731 0.582222 0.253440 Ge\n0.846419 0.153581 0.750001 Ge\n0.153580 0.846420 0.250001 Ge\n0.175359 0.367999 0.896202 O\n0.632001 0.824641 0.603800 O\n0.717668 0.531403 0.406375 O\n0.653958 0.346042 0.250001 O\n0.531402 0.717668 0.906376 O\n0.367999 0.175359 0.396202 O\n0.824641 0.632002 0.103799 O\n0.819724 0.417111 0.751127 O\n0.582889 0.180275 0.748874 O\n0.180275 0.582889 0.248874 O\n0.417111 0.819725 0.251127 O\n0.990193 0.111949 0.599441 O\n0.888051 0.009807 0.900560 O\n0.009806 0.888052 0.400560 O\n0.111948 0.990194 0.099441 O\n0.346042 0.653958 0.750001 O\n0.282332 0.468597 0.593626 O\n0.468597 0.282332 0.093626 O\n","nsites":30,"nelements":3,"elements":["Sr","Ge","O"],"chemical_system":"Ge-O-Sr","density":4.260253605691012,"density_atomic":0.06159624661990482,"volume":487.0426632506128,"volume_molar":9.776798247401564,"formula_full":"Sr6 Ge6 O18","formula_reduced":"SrGeO3","formula_anonymous":"ABC3","energy_above_hull":1.0957045519999995,"spacegroup":15},{"id":"jvasp-57174","created_at":"2022-09-04T14:37:33.806856Z","updated_at":"2022-09-04T14:37:33.806876Z","structure_string":"Na4 Ni4 F12\n1.0\n5.346565 0.000000 0.000000\n0.000000 5.576620 0.000000\n0.000000 0.000000 7.686630\nNa Ni F\n4 4 12\ndirect\n0.018534 0.935800 0.750000 Na\n0.518534 0.564200 0.250000 Na\n0.481467 0.435800 0.750000 Na\n0.981467 0.064200 0.250000 Na\n0.500000 0.000000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n0.000000 0.500000 0.000000 Ni\n0.500000 0.000000 0.000000 Ni\n0.610476 0.038486 0.750000 F\n0.110475 0.461514 0.250000 F\n0.692962 0.301950 0.056907 F\n0.192962 0.198050 0.943093 F\n0.807039 0.801950 0.443093 F\n0.192962 0.198050 0.556907 F\n0.307039 0.698050 0.943093 F\n0.807039 0.801950 0.056907 F\n0.389525 0.961514 0.250000 F\n0.692962 0.301950 0.443093 F\n0.307039 0.698050 0.556907 F\n0.889525 0.538486 0.750000 F\n","nsites":20,"nelements":3,"elements":["Na","Ni","F"],"chemical_system":"F-Na-Ni","density":4.019166199558492,"density_atomic":0.08726661212590268,"volume":229.1827253605913,"volume_molar":6.900853159409513,"formula_full":"Na4 Ni4 F12","formula_reduced":"NaNiF3","formula_anonymous":"ABC3","energy_above_hull":0.0,"spacegroup":62},{"id":"jvasp-35816","created_at":"2022-09-04T14:37:30.859513Z","updated_at":"2022-09-04T14:37:30.859543Z","structure_string":"Tb3 Al1 N1\n1.0\n4.791627 0.000000 -0.000000\n0.000000 4.791627 0.000000\n0.000000 0.000000 4.791627\nTb Al N\n3 1 1\ndirect\n0.500000 0.500000 0.000000 Tb\n0.500000 0.000000 0.500000 Tb\n0.000000 0.500000 0.500000 Tb\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 N\n","nsites":5,"nelements":3,"elements":["Tb","Al","N"],"chemical_system":"Al-N-Tb","density":7.815057541415389,"density_atomic":0.0454486506837149,"volume":110.01426719565062,"volume_molar":13.25042805320917,"formula_full":"Tb3 Al1 N1","formula_reduced":"Tb3AlN","formula_anonymous":"ABC3","energy_above_hull":2.17224025,"spacegroup":221},{"id":"jvasp-36628","created_at":"2022-09-04T14:37:17.912166Z","updated_at":"2022-09-04T14:37:17.912195Z","structure_string":"Zn1 Ir1 O3\n1.0\n3.903202 0.000000 -0.000000\n-0.000000 3.903202 0.000000\n0.000000 0.000000 3.903202\nZn Ir O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Ir\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n","nsites":5,"nelements":3,"elements":["Zn","Ir","O"],"chemical_system":"Ir-O-Zn","density":8.534414938991787,"density_atomic":0.08408275274768248,"volume":59.46522725063627,"volume_molar":7.162159376574388,"formula_full":"Zn1 Ir1 O3","formula_reduced":"ZnIrO3","formula_anonymous":"ABC3","energy_above_hull":2.1021684,"spacegroup":221},{"id":"jvasp-49685","created_at":"2022-09-04T14:37:12.132251Z","updated_at":"2022-09-04T14:37:12.132274Z","structure_string":"Al4 Co4 O12\n1.0\n4.722230 0.000000 0.000000\n0.000000 4.918390 0.000000\n0.000000 0.000000 7.361061\nAl Co O\n4 4 12\ndirect\n0.031540 0.930252 0.750000 Al\n0.531540 0.569748 0.250000 Al\n0.468460 0.430252 0.750000 Al\n0.968460 0.069748 0.250000 Al\n0.000000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 Co\n0.500000 0.000000 0.000000 Co\n0.000000 0.500000 0.000000 Co\n0.656687 0.084827 0.750000 O\n0.156687 0.415173 0.250000 O\n0.685538 0.310812 0.087022 O\n0.185538 0.189188 0.912978 O\n0.814462 0.810812 0.412978 O\n0.185538 0.189188 0.587022 O\n0.314462 0.689188 0.912978 O\n0.814462 0.810812 0.087022 O\n0.343313 0.915173 0.250000 O\n0.685538 0.310812 0.412978 O\n0.314462 0.689188 0.587022 O\n0.843313 0.584827 0.750000 O\n","nsites":20,"nelements":3,"elements":["Al","Co","O"],"chemical_system":"Al-Co-O","density":5.202607917257236,"density_atomic":0.1169821180276226,"volume":170.96630098009908,"volume_molar":5.147915648593413,"formula_full":"Al4 Co4 O12","formula_reduced":"AlCoO3","formula_anonymous":"ABC3","energy_above_hull":2.1865868400000004,"spacegroup":62},{"id":"jvasp-35806","created_at":"2022-09-04T14:37:29.797004Z","updated_at":"2022-09-04T14:37:29.797020Z","structure_string":"Sc1 Pt3 C1\n1.0\n4.241943 0.000000 -0.000000\n0.000000 4.241943 -0.000000\n-0.000000 0.000000 4.241943\nSc Pt C\n1 3 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.500000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.500000 0.500000 0.500000 C\n","nsites":5,"nelements":3,"elements":["Sc","Pt","C"],"chemical_system":"C-Pt-Sc","density":13.971321920388506,"density_atomic":0.06550516106572223,"volume":76.3298634589026,"volume_molar":9.193383638821837,"formula_full":"Sc1 Pt3 C1","formula_reduced":"ScPt3C","formula_anonymous":"ABC3","energy_above_hull":3.478653890000001,"spacegroup":221},{"id":"jvasp-36504","created_at":"2022-09-04T14:37:30.107770Z","updated_at":"2022-09-04T14:37:30.107806Z","structure_string":"Ba3 Bi1 P1\n1.0\n6.506613 -0.000000 0.000000\n-0.000000 6.506613 0.000000\n0.000000 -0.000000 6.506613\nBa Bi P\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n0.500000 0.500000 0.500000 Bi\n0.000000 0.000000 0.000000 P\n","nsites":5,"nelements":3,"elements":["Ba","Bi","P"],"chemical_system":"Ba-Bi-P","density":3.929964008781047,"density_atomic":0.018151188822357216,"volume":275.4640508086936,"volume_molar":33.17766576579489,"formula_full":"Ba3 Bi1 P1","formula_reduced":"Ba3BiP","formula_anonymous":"ABC3","energy_above_hull":0.6312615420000001,"spacegroup":221}]}