{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=updated_at&page=10211","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=updated_at&page=10209","results":[{"id":"mp-1226732","created_at":"2022-09-04T14:46:58.838057Z","structure_string":"Ce2 Te1 Se1\n1.0\n4.338500 0.000000 0.000000\n0.000000 4.338500 0.000000\n0.000000 0.000000 6.133619\nCe Te Se\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 Ce\n0.500000 0.500000 0.000000 Te\n0.000000 0.000000 0.500000 Se\n","nsites":4,"nelements":3,"elements":["Ce","Te","Se"],"chemical_system":"Ce-Se-Te","density":7.001587662316864,"density_atomic":0.03464686885612144,"volume":115.45054811766276,"volume_molar":17.381486289592956,"formula_full":"Ce2 Te1 Se1","formula_reduced":"Ce2TeSe","formula_anonymous":"ABC2","energy":-25.54666055,"energy_per_atom":-6.3866651375,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-24.65266055,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.6601443,"is_theoretical":true,"updated_at":"2021-11-28T01:37:49.481000Z","spacegroup":123},{"id":"mp-1187951","created_at":"2022-09-04T14:47:05.685855Z","structure_string":"Zn1 Co3\n1.0\n-1.785316 1.785316 3.583517\n1.785316 -1.785316 3.583517\n1.785316 1.785316 -3.583517\nZn Co\n1 3\ndirect\n0.000000 0.000000 0.000000 Zn\n0.750000 0.250000 0.500000 Co\n0.250000 0.750000 0.500000 Co\n0.500000 0.500000 0.000000 Co\n","nsites":4,"nelements":2,"elements":["Zn","Co"],"chemical_system":"Co-Zn","density":8.8031677006385,"density_atomic":0.08755084390662879,"volume":45.687737793434856,"volume_molar":6.878449699950913,"formula_full":"Zn1 Co3","formula_reduced":"ZnCo3","formula_anonymous":"AB3","energy":-22.3958012,"energy_per_atom":-5.5989503,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-22.3958012,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.4494102,"is_theoretical":true,"updated_at":"2021-11-28T01:37:49.485000Z","spacegroup":139},{"id":"mp-1210223","created_at":"2022-09-04T14:46:56.129602Z","structure_string":"Na4 Tb2 Ir3 O12\n1.0\n0.000000 0.000000 -3.207709\n-4.740588 -8.210938 0.000000\n-4.740588 8.210938 0.000000\nNa Tb Ir O\n4 2 3 12\ndirect\n0.500000 0.300980 0.300980 Na\n0.500000 0.000000 0.699020 Na\n0.500000 0.699020 0.000000 Na\n0.000000 0.000000 0.000000 Na\n0.500000 0.666667 0.333333 Tb\n0.500000 0.333333 0.666667 Tb\n0.000000 0.670423 0.670423 Ir\n0.000000 0.000000 0.329577 Ir\n0.000000 0.329577 0.000000 Ir\n0.500000 0.543506 0.543506 O\n0.500000 0.000000 0.456494 O\n0.500000 0.456494 0.000000 O\n0.500000 0.803467 0.803467 O\n0.500000 0.000000 0.196533 O\n0.500000 0.196533 0.000000 O\n0.000000 0.756718 0.216224 O\n0.000000 0.459506 0.243282 O\n0.000000 0.540494 0.783776 O\n0.000000 0.783776 0.540494 O\n0.000000 0.216224 0.756718 O\n0.000000 0.243282 0.459506 O\n","nsites":21,"nelements":4,"elements":["Na","Tb","Ir","O"],"chemical_system":"Ir-Na-O-Tb","density":7.836310439974995,"density_atomic":0.08409484041320764,"volume":249.71805519595011,"volume_molar":7.16112989858791,"formula_full":"Na4 Tb2 Ir3 O12","formula_reduced":"Na4Tb2(IrO4)3","formula_anonymous":"A2B3C4D12","energy":-144.75647753,"energy_per_atom":-6.893165596666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-136.51247753,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0073535,"is_theoretical":true,"updated_at":"2021-11-28T01:37:49.486000Z","spacegroup":189},{"id":"mp-556127","created_at":"2022-09-04T14:47:08.657518Z","structure_string":"Mg4 H24 C8 O24\n1.0\n7.558490 0.000000 0.000000\n0.000000 8.536773 0.000000\n0.000000 0.000000 8.754608\nMg H C O\n4 24 8 24\ndirect\n0.500000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.838334 0.481740 0.115839 H\n0.930376 0.312574 0.827277 H\n0.161666 0.018260 0.615839 H\n0.154695 0.880808 0.492740 H\n0.569624 0.812574 0.172723 H\n0.069624 0.687426 0.172723 H\n0.430376 0.687426 0.672723 H\n0.930376 0.812574 0.672723 H\n0.345305 0.380808 0.507260 H\n0.661666 0.981740 0.884161 H\n0.845305 0.119192 0.507260 H\n0.338334 0.018260 0.115839 H\n0.154695 0.380808 0.007260 H\n0.661666 0.481740 0.615839 H\n0.069624 0.187426 0.327277 H\n0.569624 0.312574 0.327277 H\n0.654695 0.619192 0.492740 H\n0.845305 0.619192 0.992740 H\n0.345305 0.880808 0.992740 H\n0.161666 0.518260 0.884161 H\n0.430376 0.187426 0.827277 H\n0.838334 0.981740 0.384161 H\n0.654695 0.119192 0.007260 H\n0.338334 0.518260 0.384161 H\n0.516386 0.733228 0.261687 C\n0.483614 0.766772 0.761687 C\n0.483614 0.266772 0.738313 C\n0.016386 0.766772 0.261687 C\n0.016386 0.266772 0.238313 C\n0.983614 0.233228 0.738313 C\n0.983614 0.733228 0.761687 C\n0.516386 0.233228 0.238313 C\n0.043848 0.601094 0.720283 O\n0.772078 0.532285 0.031165 O\n0.727922 0.032285 0.968835 O\n0.978635 0.278865 0.599980 O\n0.543848 0.898906 0.720283 O\n0.272078 0.967715 0.031165 O\n0.227922 0.967715 0.531165 O\n0.456152 0.101094 0.279717 O\n0.043848 0.101094 0.779717 O\n0.272078 0.467715 0.468835 O\n0.021365 0.721135 0.400020 O\n0.543848 0.398906 0.779717 O\n0.521365 0.778865 0.400020 O\n0.021365 0.221135 0.099980 O\n0.956152 0.898906 0.220283 O\n0.956152 0.398906 0.279717 O\n0.521365 0.278865 0.099980 O\n0.727922 0.532285 0.531165 O\n0.456152 0.601094 0.220283 O\n0.227922 0.467715 0.968835 O\n0.978635 0.778865 0.900020 O\n0.478635 0.221135 0.599980 O\n0.478635 0.721135 0.900020 O\n0.772078 0.032285 0.468835 O\n","nsites":60,"nelements":4,"elements":["Mg","H","C","O"],"chemical_system":"C-H-Mg-O","density":1.768096964141397,"density_atomic":0.10621497947736064,"volume":564.8920735590671,"volume_molar":5.669765968634961,"formula_full":"Mg4 H24 C8 O24","formula_reduced":"MgH6(CO3)2","formula_anonymous":"AB2C6D6","energy":-370.51197304,"energy_per_atom":-6.175199550666666,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-354.02397304,"band_gap":4.7895,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.000814,"is_theoretical":false,"updated_at":"2021-11-28T01:37:49.487000Z","spacegroup":61},{"id":"mp-25333","created_at":"2022-09-04T14:46:56.643716Z","structure_string":"Bi4 O8\n1.0\n-2.200503 3.247958 6.482392\n2.200503 -3.247958 6.482392\n2.200503 3.247958 -6.482392\nBi O\n4 8\ndirect\n0.661250 0.376435 0.284815 Bi\n0.908379 0.123565 0.784815 Bi\n0.091621 0.876435 0.215185 Bi\n0.338750 0.623565 0.715185 Bi\n0.650872 0.223815 0.427057 O\n0.947921 0.576720 0.371201 O\n0.205519 0.076720 0.128799 O\n0.203241 0.276185 0.927057 O\n0.349128 0.776185 0.572943 O\n0.052079 0.423280 0.628799 O\n0.794481 0.923280 0.871201 O\n0.796759 0.723815 0.072943 O\n","nsites":12,"nelements":2,"elements":["Bi","O"],"chemical_system":"Bi-O","density":8.636961748133245,"density_atomic":0.06475206084670626,"volume":185.32228693707134,"volume_molar":9.300307482501275,"formula_full":"Bi4 O8","formula_reduced":"BiO2","formula_anonymous":"AB2","energy":-68.11860065,"energy_per_atom":-5.676550054166667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-62.62260065000001,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":3.999942,"is_theoretical":true,"updated_at":"2021-11-28T01:37:49.491000Z","spacegroup":72},{"id":"mp-1111607","created_at":"2022-09-04T14:46:55.769788Z","structure_string":"Na3 Sb1 Cl6\n1.0\n0.000000 5.345219 5.345219\n5.345219 0.000000 5.345219\n5.345219 5.345219 0.000000\nNa Sb Cl\n3 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sb\n0.752941 0.247059 0.247059 Cl\n0.247059 0.247059 0.752941 Cl\n0.247059 0.752941 0.752941 Cl\n0.247059 0.752941 0.247059 Cl\n0.752941 0.247059 0.752941 Cl\n0.752941 0.752941 0.247059 Cl\n","nsites":10,"nelements":3,"elements":["Na","Sb","Cl"],"chemical_system":"Cl-Na-Sb","density":2.1933574452965634,"density_atomic":0.03273960941232229,"volume":305.4404184869803,"volume_molar":18.39405193921902,"formula_full":"Na3 Sb1 Cl6","formula_reduced":"Na3SbCl6","formula_anonymous":"AB3C6","energy":-35.58419639,"energy_per_atom":-3.5584196390000002,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-31.90019639,"band_gap":2.9873000000000003,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":8.85e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:37:49.495000Z","spacegroup":225},{"id":"mp-766938","created_at":"2022-09-04T14:46:41.502695Z","structure_string":"K6 Li4 Nb10 O30\n1.0\n12.743619 0.000000 0.000000\n0.000000 12.743619 0.000000\n0.000000 0.000000 4.171706\nK Li Nb O\n6 4 10 30\ndirect\n0.000000 0.000000 0.492982 K\n0.671919 0.171919 0.497195 K\n0.171919 0.328081 0.497195 K\n0.500000 0.500000 0.492982 K\n0.828081 0.671919 0.497195 K\n0.328081 0.828081 0.497195 K\n0.375834 0.124166 0.547029 Li\n0.875834 0.375834 0.547029 Li\n0.124166 0.624166 0.547029 Li\n0.624166 0.875834 0.547029 Li\n0.500000 0.000000 0.008096 Nb\n0.207665 0.076339 0.012726 Nb\n0.923661 0.207665 0.012726 Nb\n0.423661 0.292335 0.012726 Nb\n0.707665 0.423661 0.012726 Nb\n0.000000 0.500000 0.008096 Nb\n0.292335 0.576339 0.012726 Nb\n0.576339 0.707665 0.012726 Nb\n0.076339 0.792335 0.012726 Nb\n0.792335 0.923661 0.012726 Nb\n0.500000 0.000000 0.456904 O\n0.345750 0.003083 0.940529 O\n0.858664 0.068267 0.965769 O\n0.216332 0.080264 0.457738 O\n0.068267 0.141336 0.965769 O\n0.496917 0.154250 0.940529 O\n0.289014 0.210986 0.950694 O\n0.919736 0.216332 0.457738 O\n0.419736 0.283668 0.457738 O\n0.789014 0.289014 0.950694 O\n0.996917 0.345750 0.940529 O\n0.568267 0.358664 0.965769 O\n0.716332 0.419736 0.457738 O\n0.358664 0.431733 0.965769 O\n0.845750 0.496917 0.940529 O\n0.000000 0.500000 0.456904 O\n0.154250 0.503083 0.940529 O\n0.641336 0.568267 0.965769 O\n0.283668 0.580264 0.457738 O\n0.431733 0.641336 0.965769 O\n0.003083 0.654250 0.940529 O\n0.210986 0.710986 0.950694 O\n0.580264 0.716332 0.457738 O\n0.080264 0.783668 0.457738 O\n0.710986 0.789014 0.950694 O\n0.503083 0.845750 0.940529 O\n0.931733 0.858664 0.965769 O\n0.783668 0.919736 0.457738 O\n0.141336 0.931733 0.965769 O\n0.654250 0.996917 0.940529 O\n","nsites":50,"nelements":4,"elements":["K","Li","Nb","O"],"chemical_system":"K-Li-Nb-O","density":4.096662060255352,"density_atomic":0.07380244551193799,"volume":677.4843252573819,"volume_molar":8.159811938787156,"formula_full":"K6 Li4 Nb10 O30","formula_reduced":"K3Li2Nb5O15","formula_anonymous":"A2B3C5D15","energy":-407.12725668,"energy_per_atom":-8.1425451336,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-386.51725668,"band_gap":2.2722,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001688,"is_theoretical":true,"updated_at":"2021-11-28T01:37:49.497000Z","spacegroup":100},{"id":"mp-1378486","created_at":"2022-09-04T14:46:42.749389Z","structure_string":"Fe8 O12\n1.0\n1.509704 -4.954647 0.000000\n1.509704 4.954647 0.000000\n0.000000 0.000000 15.917065\nFe O\n8 12\ndirect\n0.634697 0.365303 0.047394 Fe\n0.365303 0.634697 0.952606 Fe\n0.634697 0.365303 0.452606 Fe\n0.365303 0.634697 0.547394 Fe\n0.096207 0.903793 0.647299 Fe\n0.903793 0.096207 0.352701 Fe\n0.903793 0.096207 0.147299 Fe\n0.096207 0.903793 0.852701 Fe\n0.000000 0.000000 0.500000 O\n0.000000 0.000000 0.000000 O\n0.471294 0.528706 0.852519 O\n0.528706 0.471294 0.147481 O\n0.528706 0.471294 0.352519 O\n0.471294 0.528706 0.647481 O\n0.728113 0.271887 0.927494 O\n0.271887 0.728113 0.072506 O\n0.271887 0.728113 0.427494 O\n0.728113 0.271887 0.572506 O\n0.179443 0.820557 0.750000 O\n0.820557 0.179443 0.250000 O\n","nsites":20,"nelements":2,"elements":["Fe","O"],"chemical_system":"Fe-O","density":4.454350681342173,"density_atomic":0.08399094863212975,"volume":238.12089666468222,"volume_molar":7.169987788060654,"formula_full":"Fe8 O12","formula_reduced":"Fe2O3","formula_anonymous":"A2B3","energy":-155.77406041,"energy_per_atom":-7.7887030205,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-129.48206041,"band_gap":0.5554000000000001,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":40.003833,"is_theoretical":true,"updated_at":"2021-11-28T01:37:49.497000Z","spacegroup":63},{"id":"mp-861868","created_at":"2022-09-04T14:46:57.359987Z","structure_string":"K2 Na2 La2 Ta2 O10\n1.0\n5.849138 0.000000 0.000000\n0.000000 5.849138 0.000000\n0.000000 0.000000 8.360251\nK Na La Ta O\n2 2 2 2 10\ndirect\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 K\n0.500000 0.000000 0.241067 Na\n0.000000 0.500000 0.758933 Na\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.500000 La\n0.000000 0.500000 0.253997 Ta\n0.500000 0.000000 0.746003 Ta\n0.000000 0.500000 0.031928 O\n0.771572 0.271572 0.324694 O\n0.228428 0.271572 0.324694 O\n0.771572 0.728428 0.324694 O\n0.228428 0.728428 0.324694 O\n0.271572 0.771572 0.675306 O\n0.728428 0.771572 0.675306 O\n0.271572 0.228428 0.675306 O\n0.728428 0.228428 0.675306 O\n0.500000 0.000000 0.968072 O\n","nsites":18,"nelements":5,"elements":["K","Na","La","Ta","O"],"chemical_system":"K-La-Na-O-Ta","density":5.363646222697965,"density_atomic":0.06293169843134827,"volume":286.02437958409894,"volume_molar":9.569328192483967,"formula_full":"K2 Na2 La2 Ta2 O10","formula_reduced":"KNaLaTaO5","formula_anonymous":"ABCDE5","energy":-144.66411198999998,"energy_per_atom":-8.036895110555555,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-137.79411199,"band_gap":3.7151,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":5.95e-05,"is_theoretical":false,"updated_at":"2021-11-28T01:37:49.497000Z","spacegroup":129},{"id":"mp-1197356","created_at":"2022-09-04T14:46:59.227209Z","structure_string":"Eu4 Ga32 Co8\n1.0\n0.000000 0.000000 4.050552\n12.547478 0.000000 0.000000\n0.000000 14.321462 0.000000\nEu Ga Co\n4 32 8\ndirect\n0.500000 0.157413 0.319375 Eu\n0.500000 0.842587 0.680625 Eu\n0.500000 0.657413 0.180625 Eu\n0.500000 0.342587 0.819375 Eu\n0.000000 0.500000 0.500000 Ga\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.000000 Ga\n0.500000 0.000000 0.500000 Ga\n0.500000 0.661971 0.454744 Ga\n0.500000 0.338029 0.545256 Ga\n0.500000 0.161971 0.045256 Ga\n0.500000 0.838029 0.954744 Ga\n0.500000 0.402240 0.255005 Ga\n0.500000 0.597760 0.744995 Ga\n0.500000 0.902240 0.244995 Ga\n0.500000 0.097760 0.755005 Ga\n0.000000 0.550024 0.318795 Ga\n0.000000 0.449976 0.681205 Ga\n0.000000 0.050024 0.181205 Ga\n0.000000 0.949976 0.818795 Ga\n0.000000 0.336697 0.379684 Ga\n0.000000 0.663303 0.620316 Ga\n0.000000 0.836697 0.120316 Ga\n0.000000 0.163303 0.879684 Ga\n0.000000 0.170128 0.490406 Ga\n0.000000 0.829872 0.509594 Ga\n0.000000 0.670128 0.009594 Ga\n0.000000 0.329872 0.990406 Ga\n0.000000 0.761160 0.325674 Ga\n0.000000 0.238840 0.674326 Ga\n0.000000 0.261160 0.174326 Ga\n0.000000 0.738840 0.825674 Ga\n0.000000 0.976728 0.366532 Ga\n0.000000 0.023272 0.633468 Ga\n0.000000 0.476728 0.133468 Ga\n0.000000 0.523272 0.866532 Ga\n0.500000 0.848049 0.402777 Co\n0.500000 0.151951 0.597223 Co\n0.500000 0.348049 0.097223 Co\n0.500000 0.651951 0.902777 Co\n0.500000 0.466398 0.407000 Co\n0.500000 0.533602 0.593000 Co\n0.500000 0.966398 0.093000 Co\n0.500000 0.033602 0.907000 Co\n","nsites":44,"nelements":3,"elements":["Eu","Ga","Co"],"chemical_system":"Co-Eu-Ga","density":7.552297898767584,"density_atomic":0.060449771935336544,"volume":727.8770223825996,"volume_molar":9.962222465358376,"formula_full":"Eu4 Ga32 Co8","formula_reduced":"Eu(Ga4Co)2","formula_anonymous":"AB2C8","energy":-211.19488757,"energy_per_atom":-4.799883808409091,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-211.19488757,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":27.5730182,"is_theoretical":false,"updated_at":"2021-11-28T01:37:49.503000Z","spacegroup":55},{"id":"mp-1207255","created_at":"2022-09-04T14:46:54.893735Z","structure_string":"Tl2 Fe1 Se2\n1.0\n5.218094 0.000000 0.000000\n0.000000 5.218094 0.000000\n-2.609047 -2.609047 5.874149\nTl Fe Se\n2 1 2\ndirect\n0.250000 0.750000 0.500000 Tl\n0.750000 0.250000 0.500000 Tl\n0.000000 0.000000 0.000000 Fe\n0.397535 0.397535 0.795069 Se\n0.602465 0.602465 0.204931 Se\n","nsites":5,"nelements":3,"elements":["Tl","Fe","Se"],"chemical_system":"Fe-Se-Tl","density":6.463112920459501,"density_atomic":0.03126088359870595,"volume":159.9442953751626,"volume_molar":19.264141210164922,"formula_full":"Tl2 Fe1 Se2","formula_reduced":"Tl2FeSe2","formula_anonymous":"AB2C2","energy":-18.02719859,"energy_per_atom":-3.6054397180000004,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-17.08319859,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":3.9999881,"is_theoretical":true,"updated_at":"2021-11-28T01:37:49.505000Z","spacegroup":139},{"id":"mp-1222428","created_at":"2022-09-04T14:46:42.395863Z","structure_string":"Lu1 V2 Fe10\n1.0\n0.000000 0.000000 4.683651\n-4.224675 4.190195 2.341826\n-4.224675 -4.190195 -2.341826\nLu V Fe\n1 2 10\ndirect\n0.000000 0.000000 0.000000 Lu\n0.000000 0.357855 0.357855 V\n0.000000 0.642145 0.642145 V\n0.500000 0.000000 0.500000 Fe\n0.000000 0.000000 0.500000 Fe\n0.500000 0.500000 0.000000 Fe\n0.000000 0.500000 0.000000 Fe\n0.721547 0.778453 0.221547 Fe\n0.278453 0.221547 0.778453 Fe\n0.500000 0.776013 0.776013 Fe\n0.500000 0.223987 0.223987 Fe\n0.641914 0.358086 0.641914 Fe\n0.358086 0.641914 0.358086 Fe\n","nsites":13,"nelements":3,"elements":["Lu","V","Fe"],"chemical_system":"Fe-Lu-V","density":8.364683594288476,"density_atomic":0.0783973334677345,"volume":165.821966449284,"volume_molar":7.681563254289119,"formula_full":"Lu1 V2 Fe10","formula_reduced":"Lu(VFe5)2","formula_anonymous":"AB2C10","energy":-108.48071147999998,"energy_per_atom":-8.344670113846153,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-108.48071147999998,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":16.7867285,"is_theoretical":true,"updated_at":"2021-11-28T01:37:49.505000Z","spacegroup":71}]}