{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=elements&page=50","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=elements&page=48","results":[{"id":"mp-7761","created_at":"2022-09-04T14:45:25.947961Z","structure_string":"Sb1\n1.0\n-1.892661 1.892661 1.892661\n1.892661 -1.892661 1.892661\n1.892661 1.892661 -1.892661\nSb\n1\ndirect\n0.000000 0.000000 0.000000 Sb\n","nsites":1,"nelements":1,"elements":["Sb"],"chemical_system":"Sb","density":7.455473759771788,"density_atomic":0.036874106791514365,"volume":27.119300967857598,"volume_molar":16.33162477412427,"formula_full":"Sb1","formula_reduced":"Sb","formula_anonymous":"A","energy":-3.8904761,"energy_per_atom":-3.8904761,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-3.8904761,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.000108,"is_theoretical":false,"updated_at":"2021-11-28T01:37:00.477000Z","spacegroup":229},{"id":"mp-1179605","created_at":"2022-09-04T14:42:09.296904Z","structure_string":"Sb2\n1.0\n4.347518 0.000000 0.000000\n0.000000 3.122402 0.000000\n0.000000 0.038915 4.405852\nSb\n2\ndirect\n0.750000 0.011389 0.758834 Sb\n0.250000 0.988611 0.241166 Sb\n","nsites":2,"nelements":1,"elements":["Sb"],"chemical_system":"Sb","density":6.761197511367673,"density_atomic":0.03344027852635407,"volume":59.808114290190886,"volume_molar":18.00864414228485,"formula_full":"Sb2","formula_reduced":"Sb","formula_anonymous":"A","energy":-8.15703779,"energy_per_atom":-4.078518895,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-8.15703779,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0002955,"is_theoretical":true,"updated_at":"2021-11-28T01:35:40.968000Z","spacegroup":11},{"id":"mp-1977495","created_at":"2022-09-04T14:39:25.505549Z","structure_string":"Sc3\n1.0\n1.879878 0.000000 -2.590497\n0.000000 5.000534 0.000000\n3.561597 -2.500267 2.590497\nSc\n3\ndirect\n0.995108 0.333234 0.666467 Sc\n0.500000 0.000000 0.000000 Sc\n0.004892 0.666766 0.333533 Sc\n","nsites":3,"nelements":1,"elements":["Sc"],"chemical_system":"Sc","density":3.1771743534142263,"density_atomic":0.04256034485950269,"volume":70.48815064594508,"volume_molar":14.149652170065538,"formula_full":"Sc3","formula_reduced":"Sc","formula_anonymous":"A","energy":-18.8014401,"energy_per_atom":-6.2671467000000005,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-18.8014401,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0418928,"is_theoretical":true,"updated_at":"2021-11-28T01:34:32.358000Z","spacegroup":191},{"id":"mp-1064244","created_at":"2022-09-04T14:42:57.492604Z","structure_string":"Sc4\n1.0\n5.422676 0.000000 0.000000\n0.000000 5.422676 0.000000\n0.000000 0.000000 3.435206\nSc\n4\ndirect\n0.500000 0.500000 0.000000 Sc\n0.000000 0.000000 0.000000 Sc\n0.500000 0.000000 0.532664 Sc\n0.000000 0.500000 0.467336 Sc\n","nsites":4,"nelements":1,"elements":["Sc"],"chemical_system":"Sc","density":2.956077409580834,"density_atomic":0.039598605549596946,"volume":101.01365804384275,"volume_molar":15.207961685563184,"formula_full":"Sc4","formula_reduced":"Sc","formula_anonymous":"A","energy":-24.87992786,"energy_per_atom":-6.219981965,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-24.87992786,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0881651,"is_theoretical":false,"updated_at":"2021-11-28T01:36:03.099000Z","spacegroup":129},{"id":"mp-1008681","created_at":"2022-09-04T14:42:19.616764Z","structure_string":"Sc1\n1.0\n2.989426 0.000000 0.000000\n0.000000 2.989426 0.000000\n0.000000 0.000000 2.989426\nSc\n1\ndirect\n0.000000 0.000000 0.000000 Sc\n","nsites":1,"nelements":1,"elements":["Sc"],"chemical_system":"Sc","density":2.7942965058753915,"density_atomic":0.03743144369837954,"volume":26.715507103010598,"volume_molar":16.088454424910964,"formula_full":"Sc1","formula_reduced":"Sc","formula_anonymous":"A","energy":-5.61301517,"energy_per_atom":-5.61301517,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-5.61301517,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.9076781,"is_theoretical":true,"updated_at":"2021-11-28T01:35:44.836000Z","spacegroup":221},{"id":"mp-67","created_at":"2022-09-04T14:45:05.794040Z","structure_string":"Sc2\n1.0\n1.659328 -2.874040 0.000000\n1.659328 2.874040 0.000000\n0.000000 0.000000 5.178040\nSc\n2\ndirect\n0.333333 0.666667 0.750000 Sc\n0.666667 0.333333 0.250000 Sc\n","nsites":2,"nelements":1,"elements":["Sc"],"chemical_system":"Sc","density":3.023050895931203,"density_atomic":0.0404957595482284,"volume":49.38788708526633,"volume_molar":14.871040393322998,"formula_full":"Sc2","formula_reduced":"Sc","formula_anonymous":"A","energy":-12.66493821,"energy_per_atom":-6.332469105,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-12.66493821,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.8552319,"is_theoretical":false,"updated_at":"2021-11-28T01:36:52.094000Z","spacegroup":194},{"id":"mp-567308","created_at":"2022-09-04T14:39:44.420730Z","structure_string":"Sc4\n1.0\n-3.077471 3.077471 2.702332\n3.077471 -3.077471 2.702332\n3.077471 3.077471 -2.702332\nSc\n4\ndirect\n0.664576 0.164576 0.829152 Sc\n0.335424 0.835424 0.170848 Sc\n0.835424 0.664576 0.500000 Sc\n0.164576 0.335424 0.500000 Sc\n","nsites":4,"nelements":1,"elements":["Sc"],"chemical_system":"Sc","density":2.9168175716603804,"density_atomic":0.03907269414054031,"volume":102.37328364438929,"volume_molar":15.412658104247951,"formula_full":"Sc4","formula_reduced":"Sc","formula_anonymous":"A","energy":-24.50694226,"energy_per_atom":-6.126735565,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-24.50694226,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0027389,"is_theoretical":false,"updated_at":"2021-11-28T01:34:37.036000Z","spacegroup":140},{"id":"mp-10641","created_at":"2022-09-04T14:46:00.561683Z","structure_string":"Sc1\n1.0\n-1.838692 1.838692 1.838692\n1.838692 -1.838692 1.838692\n1.838692 1.838692 -1.838692\nSc\n1\ndirect\n0.000000 0.000000 0.000000 Sc\n","nsites":1,"nelements":1,"elements":["Sc"],"chemical_system":"Sc","density":3.0022645557526153,"density_atomic":0.04021731281916648,"volume":24.86491338932588,"volume_molar":14.974000841572915,"formula_full":"Sc1","formula_reduced":"Sc","formula_anonymous":"A","energy":-6.23023766,"energy_per_atom":-6.23023766,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-6.23023766,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0707755,"is_theoretical":true,"updated_at":"2021-11-28T01:37:14.804000Z","spacegroup":229},{"id":"mp-601273","created_at":"2022-09-04T14:40:16.313226Z","structure_string":"Sc6\n1.0\n1.616966 -2.800667 0.000000\n1.616966 2.800667 0.000000\n0.000000 0.000000 16.385516\nSc\n6\ndirect\n0.529844 0.000000 0.500000 Sc\n0.470156 0.000000 0.000000 Sc\n0.000000 0.470156 0.333333 Sc\n0.470156 0.470156 0.166667 Sc\n0.000000 0.529844 0.833333 Sc\n0.529844 0.529844 0.666667 Sc\n","nsites":6,"nelements":1,"elements":["Sc"],"chemical_system":"Sc","density":3.018107328995218,"density_atomic":0.04042953721031817,"volume":148.40634877385435,"volume_molar":14.895398699896738,"formula_full":"Sc6","formula_reduced":"Sc","formula_anonymous":"A","energy":-37.22857284,"energy_per_atom":-6.20476214,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-37.22857284,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.5982564,"is_theoretical":true,"updated_at":"2021-11-28T01:35:03.478000Z","spacegroup":178},{"id":"mp-1056366","created_at":"2022-09-04T14:39:31.265276Z","structure_string":"Sc1\n1.0\n0.000000 0.000000 3.360069\n-1.914780 1.914780 1.680035\n-1.914780 -1.914780 1.680035\nSc\n1\ndirect\n0.000000 0.000000 0.000000 Sc\n","nsites":1,"nelements":1,"elements":["Sc"],"chemical_system":"Sc","density":3.029841802192606,"density_atomic":0.040586728214169976,"volume":24.63859601402588,"volume_molar":14.837709332523877,"formula_full":"Sc1","formula_reduced":"Sc","formula_anonymous":"A","energy":-6.22265527,"energy_per_atom":-6.22265527,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-6.22265527,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0149012,"is_theoretical":false,"updated_at":"2021-11-28T01:34:28.897000Z","spacegroup":139},{"id":"mp-36","created_at":"2022-09-04T14:45:12.159663Z","structure_string":"Sc1\n1.0\n0.000000 2.309476 2.309476\n2.309476 0.000000 2.309476\n2.309476 2.309476 0.000000\nSc\n1\ndirect\n0.000000 0.000000 0.000000 Sc\n","nsites":1,"nelements":1,"elements":["Sc"],"chemical_system":"Sc","density":3.0301599510943404,"density_atomic":0.04059099002843269,"volume":24.636009106935607,"volume_molar":14.83615146066081,"formula_full":"Sc1","formula_reduced":"Sc","formula_anonymous":"A","energy":-6.28459597,"energy_per_atom":-6.28459597,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-6.28459597,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.003523,"is_theoretical":false,"updated_at":"2021-11-28T01:36:53.317000Z","spacegroup":225},{"id":"mp-1055932","created_at":"2022-09-04T14:47:11.383160Z","structure_string":"Sc1\n1.0\n-0.882445 0.564392 -3.041088\n-1.668220 -2.819740 -0.089223\n-1.521212 2.804144 -0.808507\nSc\n1\ndirect\n0.999917 0.000033 0.000017 Sc\n","nsites":1,"nelements":1,"elements":["Sc"],"chemical_system":"Sc","density":3.065334543066161,"density_atomic":0.04106217687501044,"volume":24.35331188221973,"volume_molar":14.665907212690778,"formula_full":"Sc1","formula_reduced":"Sc","formula_anonymous":"A","energy":-6.27999419,"energy_per_atom":-6.27999419,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-6.27999419,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0115027,"is_theoretical":true,"updated_at":"2021-11-28T01:37:53.933000Z","spacegroup":166}]}