{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-volume&page=12162","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-volume&page=12160","results":[{"id":"mp-1220071","created_at":"2022-09-04T14:39:46.355637Z","structure_string":"Ni1 Ir1\n1.0\n4.242095 -1.338541 0.000000\n4.242095 1.338541 0.000000\n3.819735 0.000000 2.279625\nNi Ir\n1 1\ndirect\n0.500000 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 Ir\n","nsites":2,"nelements":2,"elements":["Ni","Ir"],"chemical_system":"Ir-Ni","density":16.09393655787321,"density_atomic":0.07725463063110642,"volume":25.88841579671865,"volume_molar":7.795184199062362,"formula_full":"Ni1 Ir1","formula_reduced":"NiIr","formula_anonymous":"AB","energy":-14.5935692,"energy_per_atom":-7.2967846,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-14.5935692,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0341903,"is_theoretical":true,"updated_at":"2021-11-28T01:34:42.807000Z","spacegroup":166},{"id":"mp-1009220","created_at":"2022-09-04T14:42:51.011286Z","structure_string":"Na1 H1\n1.0\n2.955124 0.000000 0.000000\n0.000000 2.955124 0.000000\n0.000000 0.000000 2.955124\nNa H\n1 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 H\n","nsites":2,"nelements":2,"elements":["Na","H"],"chemical_system":"H-Na","density":1.5441580794665433,"density_atomic":0.07750020808196384,"volume":25.806382324610148,"volume_molar":7.770483343258917,"formula_full":"Na1 H1","formula_reduced":"NaH","formula_anonymous":"AB","energy":-4.949567780000001,"energy_per_atom":-2.4747838900000003,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-4.77056778,"band_gap":1.033,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0002478,"is_theoretical":true,"updated_at":"2021-11-28T01:35:52.165000Z","spacegroup":221},{"id":"mp-1221583","created_at":"2022-09-04T14:40:16.397759Z","structure_string":"Mn1 Ir1\n1.0\n4.308280 -1.324597 0.000000\n4.308280 1.324597 0.000000\n3.901028 0.000000 2.257834\nMn Ir\n1 1\ndirect\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Ir\n","nsites":2,"nelements":2,"elements":["Mn","Ir"],"chemical_system":"Ir-Mn","density":15.926079710024855,"density_atomic":0.07761046819974383,"volume":25.76971955448919,"volume_molar":7.75944392514292,"formula_full":"Mn1 Ir1","formula_reduced":"MnIr","formula_anonymous":"AB","energy":-18.10818441,"energy_per_atom":-9.054092205,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-18.10818441,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.3729957,"is_theoretical":true,"updated_at":"2021-11-28T01:34:54.128000Z","spacegroup":166},{"id":"mp-10020","created_at":"2022-09-04T14:48:24.057345Z","structure_string":"Sc1 C1\n1.0\n0.000000 2.342873 2.342873\n2.342873 0.000000 2.342873\n2.342873 2.342873 0.000000\nSc C\n1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 C\n","nsites":2,"nelements":2,"elements":["Sc","C"],"chemical_system":"C-Sc","density":3.6778435467959465,"density_atomic":0.07775955340197126,"volume":25.720312328199388,"volume_molar":7.744567061579002,"formula_full":"Sc1 C1","formula_reduced":"ScC","formula_anonymous":"AB","energy":-15.83727854,"energy_per_atom":-7.91863927,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-15.83727854,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0066208,"is_theoretical":false,"updated_at":"2021-11-28T01:39:38.883000Z","spacegroup":225},{"id":"mp-1145","created_at":"2022-09-04T14:42:39.121187Z","structure_string":"Ti1 B2\n1.0\n1.517555 -2.628483 0.000000\n1.517555 2.628483 0.000000\n0.000000 0.000000 3.223208\nTi B\n1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.333333 0.666667 0.500000 B\n0.666667 0.333333 0.500000 B\n","nsites":3,"nelements":2,"elements":["Ti","B"],"chemical_system":"B-Ti","density":4.48742516327231,"density_atomic":0.11666841942982652,"volume":25.713899396780924,"volume_molar":5.161757388529794,"formula_full":"Ti1 B2","formula_reduced":"TiB2","formula_anonymous":"AB2","energy":-24.421273660000004,"energy_per_atom":-8.140424553333334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-24.421273660000004,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.000268,"is_theoretical":false,"updated_at":"2021-11-28T01:36:02.800000Z","spacegroup":191},{"id":"mp-1215473","created_at":"2022-09-04T14:39:46.579358Z","structure_string":"Zn1 Fe1\n1.0\n2.572789 0.000000 0.000000\n0.000000 2.572789 0.000000\n0.000000 0.000000 3.883625\nZn Fe\n1 1\ndirect\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Fe\n","nsites":2,"nelements":2,"elements":["Zn","Fe"],"chemical_system":"Fe-Zn","density":7.832484482867597,"density_atomic":0.07780085452462573,"volume":25.706658522201124,"volume_molar":7.740455804497438,"formula_full":"Zn1 Fe1","formula_reduced":"ZnFe","formula_anonymous":"AB","energy":-9.74708326,"energy_per_atom":-4.87354163,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-9.74708326,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.3382787,"is_theoretical":true,"updated_at":"2021-11-28T01:34:37.036000Z","spacegroup":123},{"id":"mp-944","created_at":"2022-09-04T14:41:22.456973Z","structure_string":"Al1 B2\n1.0\n1.503493 -2.604126 0.000000\n1.503493 2.604126 0.000000\n0.000000 0.000000 3.274424\nAl B\n1 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.666667 0.333333 0.500000 B\n0.333333 0.666667 0.500000 B\n","nsites":3,"nelements":2,"elements":["Al","B"],"chemical_system":"Al-B","density":3.1476662124246797,"density_atomic":0.11700190695540116,"volume":25.640607730808537,"volume_molar":5.147044964229107,"formula_full":"Al1 B2","formula_reduced":"AlB2","formula_anonymous":"AB2","energy":-17.23332169,"energy_per_atom":-5.744440563333334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-17.23332169,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.7e-05,"is_theoretical":false,"updated_at":"2021-11-28T01:35:23.891000Z","spacegroup":191},{"id":"mp-1217408","created_at":"2022-09-04T14:39:27.143641Z","structure_string":"Tc1 Ni1\n1.0\n1.327082 -2.298573 0.000000\n1.327082 2.298573 0.000000\n0.000000 0.000000 4.200923\nTc Ni\n1 1\ndirect\n0.666667 0.333333 0.000000 Tc\n0.000000 0.000000 0.500000 Ni\n","nsites":2,"nelements":2,"elements":["Tc","Ni"],"chemical_system":"Ni-Tc","density":10.152407121223627,"density_atomic":0.07803675809952873,"volume":25.628947802382864,"volume_molar":7.717056559832113,"formula_full":"Tc1 Ni1","formula_reduced":"TcNi","formula_anonymous":"AB","energy":-15.99408681,"energy_per_atom":-7.997043405,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-15.99408681,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0079801,"is_theoretical":true,"updated_at":"2021-11-28T01:34:37.604000Z","spacegroup":187},{"id":"mp-12067","created_at":"2022-09-04T14:40:00.435971Z","structure_string":"Mn1 Al1\n1.0\n2.947898 0.000000 0.000000\n0.000000 2.947898 0.000000\n0.000000 0.000000 2.947898\nMn Al\n1 1\ndirect\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Al\n","nsites":2,"nelements":2,"elements":["Mn","Al"],"chemical_system":"Al-Mn","density":5.3100605852411045,"density_atomic":0.07807152061622735,"volume":25.61753612858791,"volume_molar":7.713620424537094,"formula_full":"Mn1 Al1","formula_reduced":"MnAl","formula_anonymous":"AB","energy":-13.35677073,"energy_per_atom":-6.678385365,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-13.35677073,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.9212481,"is_theoretical":false,"updated_at":"2021-11-28T01:34:46.608000Z","spacegroup":221},{"id":"mp-1059612","created_at":"2022-09-04T14:45:57.489754Z","structure_string":"Li1 N1\n1.0\n0.000000 2.338122 2.338122\n2.338122 0.000000 2.338122\n2.338122 2.338122 0.000000\nLi N\n1 1\ndirect\n0.500000 0.500000 0.500000 Li\n0.250000 0.250000 0.250000 N\n","nsites":2,"nelements":2,"elements":["Li","N"],"chemical_system":"Li-N","density":1.3606735493532864,"density_atomic":0.07823453310335766,"volume":25.564158443404377,"volume_molar":7.6975480278561825,"formula_full":"Li1 N1","formula_reduced":"LiN","formula_anonymous":"AB","energy":-8.24365079,"energy_per_atom":-4.121825395,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-7.88265079,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.000007,"is_theoretical":false,"updated_at":"2021-11-28T01:37:11.832000Z","spacegroup":216},{"id":"mp-1055956","created_at":"2022-09-04T14:47:29.168069Z","structure_string":"Mg1\n1.0\n1.527549 -2.645793 0.000000\n1.527549 2.645793 0.000000\n0.000000 0.000000 3.159751\nMg\n1\ndirect\n0.000000 0.000000 0.000000 Mg\n","nsites":1,"nelements":1,"elements":["Mg"],"chemical_system":"Mg","density":1.5801956208360088,"density_atomic":0.03915309796461064,"volume":25.540763106507466,"volume_molar":15.381007054520284,"formula_full":"Mg1","formula_reduced":"Mg","formula_anonymous":"A","energy":-1.36376991,"energy_per_atom":-1.36376991,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-1.36376991,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0012598,"is_theoretical":true,"updated_at":"2021-11-28T01:38:09.337000Z","spacegroup":191},{"id":"mp-1001828","created_at":"2022-09-04T14:47:28.960721Z","structure_string":"W1 N1\n1.0\n0.000000 2.336981 2.336981\n2.336981 0.000000 2.336981\n2.336981 2.336981 0.000000\nW N\n1 1\ndirect\n0.000000 0.000000 0.000000 W\n0.250000 0.250000 0.250000 N\n","nsites":2,"nelements":2,"elements":["W","N"],"chemical_system":"N-W","density":12.870113236711585,"density_atomic":0.07834917998167334,"volume":25.526750892195935,"volume_molar":7.686284350912976,"formula_full":"W1 N1","formula_reduced":"WN","formula_anonymous":"AB","energy":-21.257235,"energy_per_atom":-10.6286175,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-20.896235,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0129959,"is_theoretical":true,"updated_at":"2021-11-28T01:38:08.315000Z","spacegroup":216}]}