{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=spacegroup&page=10160","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=spacegroup&page=10158","results":[{"id":"mp-972318","created_at":"2022-09-04T14:39:35.405658Z","structure_string":"Ti2 Sn6\n1.0\n3.143045 -5.443914 0.000000\n3.143045 5.443914 0.000000\n0.000000 0.000000 5.492631\nTi Sn\n2 6\ndirect\n0.333333 0.666667 0.750000 Ti\n0.666667 0.333333 0.250000 Ti\n0.170864 0.341728 0.250000 Sn\n0.658272 0.829136 0.250000 Sn\n0.170864 0.829136 0.250000 Sn\n0.829136 0.658272 0.750000 Sn\n0.341728 0.170864 0.750000 Sn\n0.829136 0.170864 0.750000 Sn\n","nsites":8,"nelements":2,"elements":["Ti","Sn"],"chemical_system":"Sn-Ti","density":7.138138316455424,"density_atomic":0.04256157716111687,"volume":187.9629594015277,"volume_molar":14.149242489777066,"formula_full":"Ti2 Sn6","formula_reduced":"TiSn3","formula_anonymous":"AB3","energy":-39.03083957,"energy_per_atom":-4.87885494625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-39.03083957,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.3424992,"is_theoretical":true,"updated_at":"2021-11-28T01:34:44.376000Z","spacegroup":194},{"id":"mp-1187056","created_at":"2022-09-04T14:39:36.816427Z","structure_string":"Sn6 N2\n1.0\n3.082962 -5.339847 0.000000\n3.082962 5.339847 0.000000\n0.000000 0.000000 5.298300\nSn N\n6 2\ndirect\n0.171591 0.343183 0.250000 Sn\n0.656817 0.828409 0.250000 Sn\n0.171591 0.828409 0.250000 Sn\n0.828409 0.656817 0.750000 Sn\n0.343183 0.171591 0.750000 Sn\n0.828409 0.171591 0.750000 Sn\n0.333333 0.666667 0.750000 N\n0.666667 0.333333 0.250000 N\n","nsites":8,"nelements":2,"elements":["Sn","N"],"chemical_system":"N-Sn","density":7.046569107809805,"density_atomic":0.045859198568488926,"volume":174.44700844591324,"volume_molar":13.131805500277482,"formula_full":"Sn6 N2","formula_reduced":"Sn3N","formula_anonymous":"AB3","energy":-33.361430840000004,"energy_per_atom":-4.1701788550000005,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.63943084,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.004607,"is_theoretical":true,"updated_at":"2021-11-28T01:34:37.110000Z","spacegroup":194},{"id":"mp-1186184","created_at":"2022-09-04T14:39:35.660995Z","structure_string":"Na2 Sr6\n1.0\n4.163237 -7.210939 0.000000\n4.163237 7.210939 0.000000\n0.000000 0.000000 6.800827\nNa Sr\n2 6\ndirect\n0.333333 0.666667 0.750000 Na\n0.666667 0.333333 0.250000 Na\n0.167265 0.832735 0.250000 Sr\n0.832735 0.665471 0.750000 Sr\n0.334529 0.167265 0.750000 Sr\n0.832735 0.167265 0.750000 Sr\n0.167265 0.334529 0.250000 Sr\n0.665471 0.832735 0.250000 Sr\n","nsites":8,"nelements":2,"elements":["Na","Sr"],"chemical_system":"Na-Sr","density":2.32488919866416,"density_atomic":0.019591843709880014,"volume":408.33318795645874,"volume_molar":30.73799918566664,"formula_full":"Na2 Sr6","formula_reduced":"NaSr3","formula_anonymous":"AB3","energy":-12.4478569,"energy_per_atom":-1.5559821125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-12.4478569,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0397846,"is_theoretical":true,"updated_at":"2021-11-28T01:34:27.604000Z","spacegroup":194},{"id":"mp-1185460","created_at":"2022-09-04T14:39:35.675195Z","structure_string":"La2 Gd6\n1.0\n3.685648 -6.383730 0.000000\n3.685648 6.383730 0.000000\n0.000000 0.000000 5.884454\nLa Gd\n2 6\ndirect\n0.666667 0.333333 0.250000 La\n0.333333 0.666667 0.750000 La\n0.834649 0.165351 0.750000 Gd\n0.330701 0.165351 0.750000 Gd\n0.834649 0.669299 0.750000 Gd\n0.165351 0.834649 0.250000 Gd\n0.669299 0.834649 0.250000 Gd\n0.165351 0.330701 0.250000 Gd\n","nsites":8,"nelements":2,"elements":["La","Gd"],"chemical_system":"Gd-La","density":7.324041751371122,"density_atomic":0.028891191541519184,"volume":276.9010059174367,"volume_molar":20.84421042775496,"formula_full":"La2 Gd6","formula_reduced":"LaGd3","formula_anonymous":"AB3","energy":-94.20284255,"energy_per_atom":-11.77535531875,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-94.20284255,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":46.3910068,"is_theoretical":true,"updated_at":"2021-11-28T01:34:27.651000Z","spacegroup":194},{"id":"mp-973266","created_at":"2022-09-04T14:39:36.229567Z","structure_string":"Lu6 Al2\n1.0\n3.325986 -5.760777 0.000000\n3.325986 5.760777 0.000000\n0.000000 0.000000 5.267555\nLu Al\n6 2\ndirect\n0.828063 0.171937 0.750000 Lu\n0.343873 0.171937 0.750000 Lu\n0.828063 0.656127 0.750000 Lu\n0.171937 0.828063 0.250000 Lu\n0.656127 0.828063 0.250000 Lu\n0.171937 0.343873 0.250000 Lu\n0.666667 0.333333 0.250000 Al\n0.333333 0.666667 0.750000 Al\n","nsites":8,"nelements":2,"elements":["Lu","Al"],"chemical_system":"Al-Lu","density":9.079986254927555,"density_atomic":0.0396323141396346,"volume":201.85548519357187,"volume_molar":15.195026812672321,"formula_full":"Lu6 Al2","formula_reduced":"Lu3Al","formula_anonymous":"AB3","energy":-36.20387111,"energy_per_atom":-4.52548388875,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-36.20387111,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0456214,"is_theoretical":true,"updated_at":"2021-11-28T01:34:26.817000Z","spacegroup":194},{"id":"mp-12521","created_at":"2022-09-04T14:39:35.868456Z","structure_string":"Sr2 Ni6 Ge4\n1.0\n2.029737 -3.515608 0.000000\n2.029737 3.515608 0.000000\n0.000000 0.000000 14.216177\nSr Ni Ge\n2 6 4\ndirect\n0.000000 0.000000 0.750000 Sr\n0.000000 0.000000 0.250000 Sr\n0.000000 0.000000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.333333 0.666667 0.428352 Ni\n0.666667 0.333333 0.928352 Ni\n0.333333 0.666667 0.071648 Ni\n0.666667 0.333333 0.571648 Ni\n0.333333 0.666667 0.596535 Ge\n0.666667 0.333333 0.403465 Ge\n0.666667 0.333333 0.096535 Ge\n0.333333 0.666667 0.903465 Ge\n","nsites":12,"nelements":3,"elements":["Sr","Ni","Ge"],"chemical_system":"Ge-Ni-Sr","density":6.694657229564583,"density_atomic":0.05914638633897967,"volume":202.88644400396026,"volume_molar":10.181756034064223,"formula_full":"Sr2 Ni6 Ge4","formula_reduced":"SrNi3Ge2","formula_anonymous":"AB2C3","energy":-61.90251725,"energy_per_atom":-5.158543104166667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-61.90251725,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0016587,"is_theoretical":false,"updated_at":"2021-11-28T01:34:37.364000Z","spacegroup":194},{"id":"mp-638276","created_at":"2022-09-04T14:39:36.172281Z","structure_string":"Li2 Eu8 C6 I6 N12\n1.0\n5.369299 -9.299900 0.000000\n5.369299 9.299900 0.000000\n0.000000 0.000000 6.801364\nLi Eu C I N\n2 8 6 6 12\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.000000 0.500000 Li\n0.212378 0.787622 0.750000 Eu\n0.212378 0.424756 0.750000 Eu\n0.424756 0.212378 0.250000 Eu\n0.575244 0.787622 0.750000 Eu\n0.787622 0.575244 0.250000 Eu\n0.787622 0.212378 0.250000 Eu\n0.333333 0.666667 0.250000 Eu\n0.666667 0.333333 0.750000 Eu\n0.500000 0.000000 0.500000 C\n0.500000 0.500000 0.000000 C\n0.500000 0.500000 0.500000 C\n0.000000 0.500000 0.500000 C\n0.500000 0.000000 0.000000 C\n0.000000 0.500000 0.000000 C\n0.737023 0.868511 0.250000 I\n0.262977 0.131489 0.750000 I\n0.131489 0.868511 0.250000 I\n0.868511 0.737023 0.750000 I\n0.131489 0.262977 0.250000 I\n0.868511 0.131489 0.750000 I\n0.867838 0.433919 0.474527 N\n0.433919 0.566081 0.974527 N\n0.433919 0.867838 0.525473 N\n0.132162 0.566081 0.525473 N\n0.132162 0.566081 0.974527 N\n0.566081 0.433919 0.474527 N\n0.566081 0.132162 0.025473 N\n0.566081 0.433919 0.025473 N\n0.433919 0.867838 0.974527 N\n0.566081 0.132162 0.474527 N\n0.867838 0.433919 0.025473 N\n0.433919 0.566081 0.525473 N\n","nsites":34,"nelements":5,"elements":["Li","Eu","C","I","N"],"chemical_system":"C-Eu-I-Li-N","density":5.454550738436774,"density_atomic":0.05005610294849913,"volume":679.2378550719648,"volume_molar":12.030782272834857,"formula_full":"Li2 Eu8 C6 I6 N12","formula_reduced":"LiEu4C3(IN2)3","formula_anonymous":"AB3C3D4E6","energy":-291.41381074,"energy_per_atom":-8.57099443352941,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-284.80781074,"band_gap":0.4196,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":56.0003339,"is_theoretical":false,"updated_at":"2021-11-28T01:34:24.898000Z","spacegroup":194},{"id":"mp-1077108","created_at":"2022-09-04T14:39:36.178482Z","structure_string":"Sm2 Cu2 Sn2\n1.0\n2.276557 -3.943112 0.000000\n2.276557 3.943112 0.000000\n0.000000 0.000000 7.649070\nSm Cu Sn\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Sm\n0.000000 0.000000 0.000000 Sm\n0.333333 0.666667 0.250000 Cu\n0.666667 0.333333 0.750000 Cu\n0.333333 0.666667 0.750000 Sn\n0.666667 0.333333 0.250000 Sn\n","nsites":6,"nelements":3,"elements":["Sm","Cu","Sn"],"chemical_system":"Cu-Sm-Sn","density":8.043886927056192,"density_atomic":0.04369130109405131,"volume":137.32710745061598,"volume_molar":13.783386187187569,"formula_full":"Sm2 Cu2 Sn2","formula_reduced":"SmCuSn","formula_anonymous":"ABC","energy":-29.10145001,"energy_per_atom":-4.850241668333333,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-29.10145001,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0002496,"is_theoretical":false,"updated_at":"2021-11-28T01:34:31.017000Z","spacegroup":194},{"id":"mp-136","created_at":"2022-09-04T14:39:36.079400Z","structure_string":"Fe2\n1.0\n1.232878 -2.135407 0.000000\n1.232878 2.135407 0.000000\n0.000000 0.000000 3.900192\nFe\n2\ndirect\n0.333333 0.666667 0.250000 Fe\n0.666667 0.333333 0.750000 Fe\n","nsites":2,"nelements":1,"elements":["Fe"],"chemical_system":"Fe","density":9.03122455085898,"density_atomic":0.09738974930474643,"volume":20.536042183882355,"volume_molar":6.183546834231867,"formula_full":"Fe2","formula_reduced":"Fe","formula_anonymous":"A","energy":-16.74443058,"energy_per_atom":-8.37221529,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-16.74443058,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0173598,"is_theoretical":false,"updated_at":"2021-11-28T01:34:37.613000Z","spacegroup":194},{"id":"mp-1209381","created_at":"2022-09-04T14:39:36.096352Z","structure_string":"Pr6 Al24 Ru8\n1.0\n4.454835 -7.716000 0.000000\n4.454835 7.716000 0.000000\n0.000000 0.000000 9.709026\nPr Al Ru\n6 24 8\ndirect\n0.192182 0.384363 0.250000 Pr\n0.807818 0.615637 0.750000 Pr\n0.615637 0.807818 0.250000 Pr\n0.384363 0.192182 0.750000 Pr\n0.192182 0.807818 0.250000 Pr\n0.807818 0.192182 0.750000 Pr\n0.333333 0.666667 0.009349 Al\n0.666667 0.333333 0.990651 Al\n0.666667 0.333333 0.509349 Al\n0.333333 0.666667 0.490651 Al\n0.162277 0.324553 0.575869 Al\n0.837723 0.675447 0.424131 Al\n0.675447 0.837723 0.575869 Al\n0.837723 0.675447 0.075869 Al\n0.324553 0.162277 0.424131 Al\n0.162277 0.324553 0.924131 Al\n0.162277 0.837723 0.575869 Al\n0.324553 0.162277 0.075869 Al\n0.837723 0.162277 0.424131 Al\n0.675447 0.837723 0.924131 Al\n0.837723 0.162277 0.075869 Al\n0.162277 0.837723 0.924131 Al\n0.562694 0.125388 0.250000 Al\n0.437306 0.874612 0.750000 Al\n0.874612 0.437306 0.250000 Al\n0.125388 0.562694 0.750000 Al\n0.562694 0.437306 0.250000 Al\n0.437306 0.562694 0.750000 Al\n0.000000 0.000000 0.250000 Al\n0.000000 0.000000 0.750000 Al\n0.500000 0.000000 0.000000 Ru\n0.000000 0.500000 0.000000 Ru\n0.500000 0.000000 0.500000 Ru\n0.500000 0.500000 0.000000 Ru\n0.000000 0.500000 0.500000 Ru\n0.500000 0.500000 0.500000 Ru\n0.000000 0.000000 0.000000 Ru\n0.000000 0.000000 0.500000 Ru\n","nsites":38,"nelements":3,"elements":["Pr","Al","Ru"],"chemical_system":"Al-Pr-Ru","density":5.725882478974144,"density_atomic":0.05693169247607117,"volume":667.4665436298367,"volume_molar":10.577835469288308,"formula_full":"Pr6 Al24 Ru8","formula_reduced":"Pr3(Al3Ru)4","formula_anonymous":"A3B4C12","energy":-216.72134946,"energy_per_atom":-5.7031934068421055,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-216.72134946,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.9892593,"is_theoretical":true,"updated_at":"2021-11-28T01:34:27.709000Z","spacegroup":194},{"id":"mp-571557","created_at":"2022-09-04T14:39:36.177575Z","structure_string":"V12 Ga10\n1.0\n4.243327 -7.349658 0.000000\n4.243327 7.349658 0.000000\n0.000000 0.000000 5.124467\nV Ga\n12 10\ndirect\n0.686383 0.843191 0.250000 V\n0.843191 0.156809 0.750000 V\n0.500000 0.000000 0.000000 V\n0.156809 0.843191 0.250000 V\n0.843191 0.686383 0.750000 V\n0.313617 0.156809 0.750000 V\n0.000000 0.500000 0.000000 V\n0.500000 0.000000 0.500000 V\n0.156809 0.313617 0.250000 V\n0.500000 0.500000 0.000000 V\n0.000000 0.500000 0.500000 V\n0.500000 0.500000 0.500000 V\n0.000000 0.000000 0.000000 Ga\n0.796242 0.203758 0.250000 Ga\n0.203758 0.407517 0.750000 Ga\n0.592483 0.796242 0.750000 Ga\n0.796242 0.592483 0.250000 Ga\n0.000000 0.000000 0.500000 Ga\n0.407517 0.203758 0.250000 Ga\n0.203758 0.796242 0.750000 Ga\n0.666667 0.333333 0.750000 Ga\n0.333333 0.666667 0.250000 Ga\n","nsites":22,"nelements":2,"elements":["V","Ga"],"chemical_system":"Ga-V","density":6.797978549042689,"density_atomic":0.06882882459058938,"volume":319.633527535322,"volume_molar":8.749445883786567,"formula_full":"V12 Ga10","formula_reduced":"V6Ga5","formula_anonymous":"A5B6","energy":-143.97596054,"energy_per_atom":-6.544361842727272,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-143.97596054,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.2025813,"is_theoretical":false,"updated_at":"2021-11-28T01:34:27.395000Z","spacegroup":194},{"id":"mp-1400395","created_at":"2022-09-04T14:39:36.667911Z","structure_string":"Al2 Ni2 O6\n1.0\n1.555307 -2.693870 0.000000\n1.555307 2.693870 0.000000\n0.000000 0.000000 11.153900\nAl Ni 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 Ni\n0.333333 0.666667 0.250000 Ni\n0.333333 0.666667 0.420174 O\n0.666667 0.333333 0.920174 O\n0.666667 0.333333 0.579826 O\n0.333333 0.666667 0.079826 O\n0.000000 0.000000 0.250000 O\n0.000000 0.000000 0.750000 O\n","nsites":10,"nelements":3,"elements":["Al","Ni","O"],"chemical_system":"Al-Ni-O","density":4.749782638649847,"density_atomic":0.10699180081658712,"volume":93.4651059583781,"volume_molar":5.628600242296676,"formula_full":"Al2 Ni2 O6","formula_reduced":"AlNiO3","formula_anonymous":"ABC3","energy":-67.09563836000001,"energy_per_atom":-6.709563836000001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-57.89163836,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.8454778,"is_theoretical":true,"updated_at":"2021-11-28T01:34:28.417000Z","spacegroup":194}]}