{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_full&page=3470","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_full&page=3468","results":[{"id":"jvasp-90755","created_at":"2022-09-04T14:35:51.265891Z","updated_at":"2022-09-04T14:35:51.265911Z","structure_string":"Sc3 Ir1 C4\n1.0\n3.442839 0.000000 0.000000\n0.000000 4.451653 0.000000\n-1.721420 -2.225826 6.125119\nSc Ir C\n3 1 4\ndirect\n0.500000 0.500000 -0.000000 Sc\n0.309815 0.809814 0.619632 Sc\n0.690185 0.190184 0.380368 Sc\n0.000000 0.000000 0.000000 Ir\n0.871767 0.209659 0.743533 C\n0.128233 0.790340 0.256467 C\n0.128233 0.466126 0.256467 C\n0.871767 0.533872 0.743533 C\n","nsites":8,"nelements":3,"elements":["Sc","Ir","C"],"chemical_system":"C-Ir-Sc","density":6.635528104151295,"density_atomic":0.08521919707636581,"volume":93.87556178018336,"volume_molar":7.066648087054255,"formula_full":"Sc3 Ir1 C4","formula_reduced":"Sc3IrC4","formula_anonymous":"AB3C4","energy_above_hull":5.24885835625,"spacegroup":71},{"id":"jvasp-89952","created_at":"2022-09-04T14:35:54.370691Z","updated_at":"2022-09-04T14:35:54.370715Z","structure_string":"Sc3 Mn3 Ge3\n1.0\n0.000000 0.000000 -3.898915\n-3.296022 -5.708878 0.000000\n-3.296019 5.708876 0.000000\nSc Mn Ge\n3 3 3\ndirect\n0.500001 0.583287 -0.000000 Sc\n0.500001 0.416699 0.416708 Sc\n0.500001 -0.000010 0.583292 Sc\n0.000000 0.229992 -0.000000 Mn\n0.000000 0.769980 0.769992 Mn\n0.000000 0.999988 0.230007 Mn\n0.000000 0.333323 0.666669 Ge\n0.000000 0.666653 0.333332 Ge\n0.500001 -0.000013 0.000000 Ge\n","nsites":9,"nelements":3,"elements":["Sc","Mn","Ge"],"chemical_system":"Ge-Mn-Sc","density":5.857746616124953,"density_atomic":0.06133779451469169,"volume":146.7284578979166,"volume_molar":9.81799363287764,"formula_full":"Sc3 Mn3 Ge3","formula_reduced":"ScMnGe","formula_anonymous":"ABC","energy_above_hull":2.0776261471264363,"spacegroup":189},{"id":"jvasp-16162","created_at":"2022-09-04T14:36:48.838147Z","updated_at":"2022-09-04T14:36:48.838171Z","structure_string":"Sc3 Mn3 Si3\n1.0\n3.262792 -5.651322 0.000000\n3.262792 5.651322 -0.000000\n0.000000 0.000000 3.824163\nSc Mn Si\n3 3 3\ndirect\n0.582839 0.582839 0.500000 Sc\n-0.000000 0.417161 0.500000 Sc\n0.417161 -0.000000 0.500000 Sc\n0.769512 -0.000000 0.000000 Mn\n-0.000000 0.769512 0.000000 Mn\n0.230488 0.230488 0.000000 Mn\n0.000000 0.000000 0.500000 Si\n0.666667 0.333333 0.000000 Si\n0.333333 0.666667 0.000000 Si\n","nsites":9,"nelements":3,"elements":["Sc","Mn","Si"],"chemical_system":"Mn-Sc-Si","density":4.52069057871262,"density_atomic":0.06381704293405786,"volume":141.02815778066838,"volume_molar":9.436571303096379,"formula_full":"Sc3 Mn3 Si3","formula_reduced":"ScMnSi","formula_anonymous":"ABC","energy_above_hull":2.758030363793103,"spacegroup":189},{"id":"jvasp-104613","created_at":"2022-09-04T14:37:00.472932Z","updated_at":"2022-09-04T14:37:00.472952Z","structure_string":"Sc3 Nb1\n1.0\n4.033150 -0.005825 -3.597078\n-0.813502 3.950260 -3.597078\n0.004754 0.005825 5.404188\nSc Nb\n3 1\ndirect\n0.750000 0.250000 0.500000 Sc\n0.250000 0.750000 0.500000 Sc\n0.500000 0.500001 0.000000 Sc\n0.000000 0.000000 0.000000 Nb\n","nsites":4,"nelements":2,"elements":["Sc","Nb"],"chemical_system":"Nb-Sc","density":4.385602460722688,"density_atomic":0.04638053841903859,"volume":86.2430695362099,"volume_molar":12.9841976080381,"formula_full":"Sc3 Nb1","formula_reduced":"Sc3Nb","formula_anonymous":"AB3","energy_above_hull":3.3387512875,"spacegroup":139},{"id":"jvasp-23810","created_at":"2022-09-04T14:37:39.145192Z","updated_at":"2022-09-04T14:37:39.145214Z","structure_string":"Sc3 Ni4 Ge4\n1.0\n3.772636 0.000000 -1.016907\n-0.783399 5.889675 -2.906342\n0.005386 0.000756 7.526509\nSc Ni Ge\n3 4 4\ndirect\n0.873543 0.873532 0.747083 Sc\n0.126459 0.126468 0.252917 Sc\n-0.000000 0.500000 -0.000000 Sc\n0.677368 0.479711 0.354734 Ni\n0.322610 0.124996 0.645217 Ni\n0.322634 0.520289 0.645267 Ni\n0.677392 0.875004 0.354783 Ni\n0.782105 0.282113 0.564207 Ge\n0.217896 0.717887 0.435793 Ge\n0.500011 0.803181 0.000022 Ge\n0.499990 0.196819 0.999978 Ge\n","nsites":11,"nelements":3,"elements":["Sc","Ni","Ge"],"chemical_system":"Ge-Ni-Sc","density":6.55373426228561,"density_atomic":0.06575912362169714,"volume":167.27716846230237,"volume_molar":9.157878676492887,"formula_full":"Sc3 Ni4 Ge4","formula_reduced":"Sc3(NiGe)4","formula_anonymous":"A3B4C4","energy_above_hull":1.6004708318181815,"spacegroup":71},{"id":"jvasp-90609","created_at":"2022-09-04T14:35:51.371412Z","updated_at":"2022-09-04T14:35:51.371436Z","structure_string":"Sc3 Os1 C4\n1.0\n3.335880 0.000000 -0.000000\n-0.000000 4.494183 -0.000000\n-1.667940 -2.247093 6.207028\nSc Os C\n3 1 4\ndirect\n0.500000 0.500000 0.000000 Sc\n0.309559 0.809559 0.619119 Sc\n0.690441 0.190441 0.380881 Sc\n0.000000 0.000000 0.000000 Os\n0.871197 0.211754 0.742392 C\n0.128804 0.788246 0.257608 C\n0.128804 0.469362 0.257608 C\n0.871197 0.530638 0.742392 C\n","nsites":8,"nelements":3,"elements":["Sc","Os","C"],"chemical_system":"C-Os-Sc","density":6.658503798206969,"density_atomic":0.08596964043092692,"volume":93.05610631729549,"volume_molar":7.004962135253484,"formula_full":"Sc3 Os1 C4","formula_reduced":"Sc3OsC4","formula_anonymous":"AB3C4","energy_above_hull":5.45153009375,"spacegroup":71},{"id":"jvasp-37645","created_at":"2022-09-04T14:38:04.309362Z","updated_at":"2022-09-04T14:38:04.309378Z","structure_string":"Sc3 P1\n1.0\n-2.019500 2.019500 4.717859\n2.019500 -2.019500 4.717859\n2.019500 2.019500 -4.717859\nSc P\n3 1\ndirect\n0.750001 0.250000 0.500001 Sc\n0.250000 0.750001 0.500001 Sc\n0.500000 0.500000 0.000000 Sc\n0.000000 0.000000 0.000000 P\n","nsites":4,"nelements":2,"elements":["Sc","P"],"chemical_system":"P-Sc","density":3.5780766995958238,"density_atomic":0.05197174845222083,"volume":76.964891871539,"volume_molar":11.587335310714693,"formula_full":"Sc3 P1","formula_reduced":"Sc3P","formula_anonymous":"AB3","energy_above_hull":2.5586028125,"spacegroup":139},{"id":"jvasp-90058","created_at":"2022-09-04T14:35:56.795827Z","updated_at":"2022-09-04T14:35:56.795846Z","structure_string":"Sc3 P3 Ir3\n1.0\n0.000000 0.000000 -3.927561\n-3.192660 -5.529849 0.000000\n-3.192641 5.529838 0.000000\nSc P Ir\n3 3 3\ndirect\n0.500000 0.581753 -0.000000 Sc\n0.500000 0.418271 0.418260 Sc\n0.500000 0.000010 0.581740 Sc\n0.000000 0.666677 0.333332 P\n0.000000 0.333344 0.666668 P\n0.500000 0.000010 -0.000000 P\n0.000000 0.250462 -0.000000 Ir\n0.000000 0.749560 0.749548 Ir\n0.000000 0.000012 0.250452 Ir\n","nsites":9,"nelements":3,"elements":["Sc","P","Ir"],"chemical_system":"Ir-P-Sc","density":9.632202687524224,"density_atomic":0.06489710974356554,"volume":138.68106045958908,"volume_molar":9.27952074259684,"formula_full":"Sc3 P3 Ir3","formula_reduced":"ScPIr","formula_anonymous":"ABC","energy_above_hull":2.620880616666666,"spacegroup":189},{"id":"jvasp-17393","created_at":"2022-09-04T14:38:17.790875Z","updated_at":"2022-09-04T14:38:17.790895Z","structure_string":"Sc3 P3 Ru3\n1.0\n3.284831 -5.689494 -0.000000\n3.284831 5.689494 0.000000\n0.000000 0.000000 3.638260\nSc P Ru\n3 3 3\ndirect\n0.589359 0.000000 0.500000 Sc\n0.000000 0.589359 0.500000 Sc\n0.410641 0.410641 0.500000 Sc\n0.666667 0.333333 0.000000 P\n0.333333 0.666667 0.000000 P\n0.000000 0.000000 0.500000 P\n0.755839 0.755839 0.000000 Ru\n0.000000 0.244160 0.000000 Ru\n0.244160 0.000000 0.000000 Ru\n","nsites":9,"nelements":3,"elements":["Sc","P","Ru"],"chemical_system":"P-Ru-Sc","density":6.483841904489455,"density_atomic":0.06618081448203511,"volume":135.9910734015379,"volume_molar":9.099526512528369,"formula_full":"Sc3 P3 Ru3","formula_reduced":"ScPRu","formula_anonymous":"ABC","energy_above_hull":2.585457083333334,"spacegroup":189},{"id":"jvasp-37244","created_at":"2022-09-04T14:38:01.570349Z","updated_at":"2022-09-04T14:38:01.570376Z","structure_string":"Sc3 Pb1\n1.0\n-2.171473 2.171473 4.937735\n2.171473 -2.171473 4.937735\n2.171473 2.171473 -4.937735\nSc Pb\n3 1\ndirect\n0.749999 0.250000 0.499999 Sc\n0.250000 0.749999 0.499999 Sc\n0.500001 0.500001 0.000000 Sc\n0.000000 0.000000 0.000000 Pb\n","nsites":4,"nelements":2,"elements":["Sc","Pb"],"chemical_system":"Pb-Sc","density":6.09908342150684,"density_atomic":0.042950018395174865,"volume":93.13150842443811,"volume_molar":14.021276323077304,"formula_full":"Sc3 Pb1","formula_reduced":"Sc3Pb","formula_anonymous":"AB3","energy_above_hull":1.9384491425,"spacegroup":139},{"id":"jvasp-17939","created_at":"2022-09-04T14:38:12.732929Z","updated_at":"2022-09-04T14:38:12.732945Z","structure_string":"Sc3 Pb1 C1\n1.0\n4.543392 0.000000 0.000000\n0.000000 4.543392 0.000000\n-0.000000 0.000000 4.543392\nSc Pb C\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Sc\n0.500000 0.500000 0.000000 Sc\n0.500000 0.000000 0.500000 Sc\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500000 0.500000 C\n","nsites":5,"nelements":3,"elements":["Sc","Pb","C"],"chemical_system":"C-Pb-Sc","density":6.269139715872711,"density_atomic":0.053312540369076206,"volume":93.78656438777088,"volume_molar":11.29591784279919,"formula_full":"Sc3 Pb1 C1","formula_reduced":"Sc3PbC","formula_anonymous":"ABC3","energy_above_hull":2.851719314,"spacegroup":221},{"id":"jvasp-91794","created_at":"2022-09-04T14:35:45.037029Z","updated_at":"2022-09-04T14:35:45.037047Z","structure_string":"Sc3 Rh1 C4\n1.0\n3.391870 0.000000 0.000000\n0.000000 4.484980 -0.000000\n-1.695936 -2.242490 6.133658\nSc Rh C\n3 1 4\ndirect\n0.500000 0.500000 -0.000000 Sc\n0.311120 0.811121 0.622240 Sc\n0.688879 0.188879 0.377760 Sc\n0.000000 0.000000 0.000000 Rh\n0.871016 0.211358 0.742034 C\n0.128983 0.788643 0.257966 C\n0.128983 0.469323 0.257966 C\n0.871016 0.530677 0.742034 C\n","nsites":8,"nelements":3,"elements":["Sc","Rh","C"],"chemical_system":"C-Rh-Sc","density":5.086469242847255,"density_atomic":0.08573748118855685,"volume":93.30808287225189,"volume_molar":7.023930113780573,"formula_full":"Sc3 Rh1 C4","formula_reduced":"Sc3RhC4","formula_anonymous":"AB3C4","energy_above_hull":4.99715109375,"spacegroup":71}]}