{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=density&page=12177","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=density&page=12175","results":[{"id":"mp-1217610","created_at":"2022-09-04T14:46:28.437880Z","structure_string":"U24 Cr1 Fe3\n1.0\n0.000000 0.000000 5.229106\n-5.093316 5.093316 -2.614553\n-10.160814 -10.160814 0.000000\nU Cr Fe\n24 1 3\ndirect\n0.250000 0.500000 0.343132 U\n0.750000 0.500000 0.842080 U\n0.250000 0.500000 0.157920 U\n0.750000 0.500000 0.656868 U\n0.656758 0.312266 0.252687 U\n0.155508 0.312266 0.747313 U\n0.843242 0.687734 0.252687 U\n0.344492 0.687734 0.747313 U\n0.057140 0.114333 0.341555 U\n0.562364 0.119274 0.840367 U\n0.443090 0.880726 0.159633 U\n0.942807 0.885667 0.658445 U\n0.658981 0.317433 0.439297 U\n0.155173 0.318077 0.940989 U\n0.837096 0.681923 0.059011 U\n0.341547 0.682567 0.560703 U\n0.841019 0.682567 0.439297 U\n0.344827 0.681923 0.940989 U\n0.662904 0.318077 0.059011 U\n0.158453 0.317433 0.560703 U\n0.442860 0.885667 0.341555 U\n0.937636 0.880726 0.840367 U\n0.056910 0.119274 0.159633 U\n0.557193 0.114333 0.658445 U\n0.250000 0.000000 0.000000 Cr\n0.750000 0.000000 0.500000 Fe\n0.750000 0.000000 0.000000 Fe\n0.250000 0.000000 0.500000 Fe\n","nsites":28,"nelements":3,"elements":["U","Cr","Fe"],"chemical_system":"Cr-Fe-U","density":18.20036692814604,"density_atomic":0.05173345304331971,"volume":541.2358609921866,"volume_molar":11.640709068766935,"formula_full":"U24 Cr1 Fe3","formula_reduced":"U24CrFe3","formula_anonymous":"AB3C24","energy":-305.57952681,"energy_per_atom":-10.913554528928572,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-305.57952681,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.4312416,"is_theoretical":true,"updated_at":"2021-11-28T01:37:41.984000Z","spacegroup":21},{"id":"mp-1220045","created_at":"2022-09-04T14:47:13.476938Z","structure_string":"Os3 W3 C2\n1.0\n1.424733 -2.467709 0.000000\n1.424733 2.467709 0.000000\n0.000000 0.000000 14.871864\nOs W C\n3 3 2\ndirect\n0.666667 0.333333 0.189622 Os\n0.000000 0.000000 0.000000 Os\n0.333333 0.666667 0.810378 Os\n0.666667 0.333333 0.662002 W\n0.000000 0.000000 0.500000 W\n0.333333 0.666667 0.337998 W\n0.333333 0.666667 0.099945 C\n0.666667 0.333333 0.900055 C\n","nsites":8,"nelements":3,"elements":["Os","W","C"],"chemical_system":"C-Os-W","density":18.20113912386496,"density_atomic":0.0765010079703883,"volume":104.57378552576208,"volume_molar":7.871975703027372,"formula_full":"Os3 W3 C2","formula_reduced":"Os3W3C2","formula_anonymous":"A2B3C3","energy":-85.88671477,"energy_per_atom":-10.73583934625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-85.88671477,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0113337,"is_theoretical":true,"updated_at":"2021-11-28T01:37:56.317000Z","spacegroup":164},{"id":"mp-974411","created_at":"2022-09-04T14:45:04.884957Z","structure_string":"Re6 Tc2\n1.0\n2.775070 -4.806562 0.000000\n2.775070 4.806562 0.000000\n0.000000 0.000000 4.484377\nRe Tc\n6 2\ndirect\n0.166062 0.332124 0.250000 Re\n0.667876 0.833938 0.250000 Re\n0.166062 0.833938 0.250000 Re\n0.833938 0.667876 0.750000 Re\n0.332124 0.166062 0.750000 Re\n0.833938 0.166062 0.750000 Re\n0.333333 0.666667 0.750000 Tc\n0.666667 0.333333 0.250000 Tc\n","nsites":8,"nelements":2,"elements":["Re","Tc"],"chemical_system":"Re-Tc","density":18.228597606150466,"density_atomic":0.06687278090683856,"volume":119.63013787545215,"volume_molar":9.005369117802253,"formula_full":"Re6 Tc2","formula_reduced":"Re3Tc","formula_anonymous":"AB3","energy":-95.38273766,"energy_per_atom":-11.9228422075,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-95.38273766,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":7.19e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:36:52.101000Z","spacegroup":194},{"id":"mp-636821","created_at":"2022-09-04T14:47:15.820859Z","structure_string":"U12 Ni2\n1.0\n-5.147562 5.147562 2.555522\n5.147562 -5.147562 2.555522\n5.147562 5.147562 -2.555522\nU Ni\n12 2\ndirect\n0.105201 0.782242 0.887443 U\n0.593767 0.093767 0.687533 U\n0.906233 0.593767 0.500000 U\n0.894799 0.217758 0.112557 U\n0.406233 0.906233 0.312467 U\n0.782242 0.894799 0.677041 U\n0.217758 0.105201 0.322959 U\n0.394799 0.282242 0.677041 U\n0.282242 0.605201 0.887443 U\n0.605201 0.717758 0.322959 U\n0.093767 0.406233 0.500000 U\n0.717758 0.394799 0.112557 U\n0.250000 0.250000 0.000000 Ni\n0.750000 0.750000 0.000000 Ni\n","nsites":14,"nelements":2,"elements":["U","Ni"],"chemical_system":"Ni-U","density":18.230911680670584,"density_atomic":0.0516874667940659,"volume":270.85869879789317,"volume_molar":11.651065787366825,"formula_full":"U12 Ni2","formula_reduced":"U6Ni","formula_anonymous":"AB6","energy":-147.32239377,"energy_per_atom":-10.52302812642857,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-147.32239377,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0021265,"is_theoretical":false,"updated_at":"2021-11-28T01:38:05.933000Z","spacegroup":140},{"id":"mp-972103","created_at":"2022-09-04T14:41:54.015884Z","structure_string":"U3 C1\n1.0\n4.043269 0.000000 0.000000\n0.000000 4.043269 0.000000\n0.000000 0.000000 4.043269\nU C\n3 1\ndirect\n0.000000 0.500000 0.500000 U\n0.500000 0.000000 0.500000 U\n0.500000 0.500000 0.000000 U\n0.000000 0.000000 0.000000 C\n","nsites":4,"nelements":2,"elements":["U","C"],"chemical_system":"C-U","density":18.240892710319226,"density_atomic":0.06051486700762009,"volume":66.09945948482901,"volume_molar":9.951506229438936,"formula_full":"U3 C1","formula_reduced":"U3C","formula_anonymous":"AB3","energy":-41.26196247,"energy_per_atom":-10.3154906175,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-41.26196247,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0742164,"is_theoretical":true,"updated_at":"2021-11-28T01:35:30.574000Z","spacegroup":221},{"id":"mp-21108","created_at":"2022-09-04T14:45:27.581579Z","structure_string":"U12 Fe2\n1.0\n-5.070697 5.070697 2.626621\n5.070697 -5.070697 2.626621\n5.070697 5.070697 -2.626621\nU Fe\n12 2\ndirect\n0.093909 0.593909 0.687819 U\n0.593909 0.906091 0.500000 U\n0.406091 0.093909 0.500000 U\n0.906091 0.406091 0.312181 U\n0.899279 0.782433 0.681711 U\n0.782433 0.100721 0.883154 U\n0.217567 0.899279 0.116846 U\n0.100721 0.217567 0.318289 U\n0.717567 0.600721 0.318289 U\n0.282433 0.399279 0.681711 U\n0.399279 0.717567 0.116846 U\n0.600721 0.282433 0.883154 U\n0.750000 0.750000 0.000000 Fe\n0.250000 0.250000 0.000000 Fe\n","nsites":14,"nelements":2,"elements":["U","Fe"],"chemical_system":"Fe-U","density":18.244235639182758,"density_atomic":0.05182452284388359,"volume":270.1423810919332,"volume_molar":11.620253172694174,"formula_full":"U12 Fe2","formula_reduced":"U6Fe","formula_anonymous":"AB6","energy":-152.51387764,"energy_per_atom":-10.893848402857143,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-152.51387764,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.3326091,"is_theoretical":false,"updated_at":"2021-11-28T01:37:00.924000Z","spacegroup":140},{"id":"mp-1018948","created_at":"2022-09-04T14:45:25.033682Z","structure_string":"Re4 N2\n1.0\n1.433627 -2.483114 0.000000\n1.433627 2.483114 0.000000\n0.000000 0.000000 9.871850\nRe N\n4 2\ndirect\n0.333333 0.666667 0.394140 Re\n0.666667 0.333333 0.605860 Re\n0.666667 0.333333 0.894140 Re\n0.333333 0.666667 0.105860 Re\n0.333333 0.666667 0.750000 N\n0.666667 0.333333 0.250000 N\n","nsites":6,"nelements":2,"elements":["Re","N"],"chemical_system":"N-Re","density":18.259046829748964,"density_atomic":0.08536697194807061,"volume":70.28479355751129,"volume_molar":7.054415334847903,"formula_full":"Re4 N2","formula_reduced":"Re2N","formula_anonymous":"AB2","energy":-66.95009275999999,"energy_per_atom":-11.158348793333332,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-66.22809276,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.05e-05,"is_theoretical":false,"updated_at":"2021-11-28T01:36:56.685000Z","spacegroup":194},{"id":"mp-631377","created_at":"2022-09-04T14:47:23.714001Z","structure_string":"Re2 Pt1 Rh1\n1.0\n0.000000 3.123727 3.123727\n3.123727 0.000000 3.123727\n3.123727 3.123727 0.000000\nRe Pt Rh\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Re\n0.750000 0.750000 0.750000 Re\n0.000000 0.000000 0.000000 Pt\n0.500000 0.500000 0.500000 Rh\n","nsites":4,"nelements":3,"elements":["Re","Pt","Rh"],"chemical_system":"Pt-Re-Rh","density":18.26148792513116,"density_atomic":0.0656161555303244,"volume":60.96059678704289,"volume_molar":9.177832366629401,"formula_full":"Re2 Pt1 Rh1","formula_reduced":"Re2PtRh","formula_anonymous":"ABC2","energy":-36.14244035,"energy_per_atom":-9.0356100875,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-36.14244035,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.06323,"is_theoretical":true,"updated_at":"2021-11-28T01:38:00.449000Z","spacegroup":225},{"id":"mp-2351","created_at":"2022-09-04T14:46:24.247225Z","structure_string":"Tm1 Pt3\n1.0\n4.093085 0.000000 0.000000\n0.000000 4.093085 0.000000\n0.000000 0.000000 4.093085\nTm Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Tm\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.000000 0.500000 0.500000 Pt\n","nsites":4,"nelements":2,"elements":["Tm","Pt"],"chemical_system":"Pt-Tm","density":18.26313771022465,"density_atomic":0.05833211193200935,"volume":68.57286437121141,"volume_molar":10.3238860389956,"formula_full":"Tm1 Pt3","formula_reduced":"TmPt3","formula_anonymous":"AB3","energy":-26.93128016,"energy_per_atom":-6.73282004,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-26.93128016,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0093807,"is_theoretical":false,"updated_at":"2021-11-28T01:37:29.670000Z","spacegroup":221},{"id":"mp-12662","created_at":"2022-09-04T14:45:29.484579Z","structure_string":"Re24 Mo5\n1.0\n-4.826626 4.826626 4.826626\n4.826626 -4.826626 4.826626\n4.826626 4.826626 -4.826626\nRe Mo\n24 5\ndirect\n0.315426 0.315426 0.716771 Re\n0.401345 0.684574 0.000000 Re\n0.684574 0.401345 0.000000 Re\n0.598655 0.283229 0.598655 Re\n0.401345 0.000000 0.684574 Re\n0.000000 0.401345 0.684574 Re\n0.283229 0.598655 0.598655 Re\n0.716771 0.315426 0.315426 Re\n0.315426 0.716771 0.315426 Re\n0.684574 0.000000 0.401345 Re\n0.000000 0.684574 0.401345 Re\n0.598655 0.598655 0.283229 Re\n0.806504 0.806504 0.181977 Re\n0.375474 0.193496 0.000000 Re\n0.193496 0.375474 0.000000 Re\n0.624526 0.818023 0.624526 Re\n0.375474 0.000000 0.193496 Re\n0.000000 0.375474 0.193496 Re\n0.818023 0.624526 0.624526 Re\n0.181977 0.806504 0.806504 Re\n0.806504 0.181977 0.806504 Re\n0.193496 0.000000 0.375474 Re\n0.000000 0.193496 0.375474 Re\n0.624526 0.624526 0.818023 Re\n0.000000 0.000000 0.000000 Mo\n0.000000 0.000000 0.641448 Mo\n0.641448 0.000000 0.000000 Mo\n0.000000 0.641448 0.000000 Mo\n0.358552 0.358552 0.358552 Mo\n","nsites":29,"nelements":2,"elements":["Re","Mo"],"chemical_system":"Mo-Re","density":18.27033374079881,"density_atomic":0.06447733259053604,"volume":449.7704671526162,"volume_molar":9.33993469960004,"formula_full":"Re24 Mo5","formula_reduced":"Re24Mo5","formula_anonymous":"A5B24","energy":-353.29788149,"energy_per_atom":-12.18268556862069,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-353.29788149,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.001944,"is_theoretical":false,"updated_at":"2021-11-28T01:37:01.717000Z","spacegroup":217},{"id":"mp-1186231","created_at":"2022-09-04T14:41:35.201788Z","structure_string":"Nb2 Ir6\n1.0\n2.796634 -4.843912 0.000000\n2.796634 4.843912 0.000000\n0.000000 0.000000 4.491002\nNb Ir\n2 6\ndirect\n0.333333 0.666667 0.750000 Nb\n0.666667 0.333333 0.250000 Nb\n0.163811 0.327621 0.250000 Ir\n0.672379 0.836189 0.250000 Ir\n0.163811 0.836189 0.250000 Ir\n0.836189 0.672379 0.750000 Ir\n0.327621 0.163811 0.750000 Ir\n0.836189 0.163811 0.750000 Ir\n","nsites":8,"nelements":2,"elements":["Nb","Ir"],"chemical_system":"Ir-Nb","density":18.275184593206422,"density_atomic":0.06574835099169861,"volume":121.67605543460824,"volume_molar":9.159379161859674,"formula_full":"Nb2 Ir6","formula_reduced":"NbIr3","formula_anonymous":"AB3","energy":-78.13001429,"energy_per_atom":-9.76625178625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-78.13001429,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0003734,"is_theoretical":true,"updated_at":"2021-11-28T01:35:27.865000Z","spacegroup":194},{"id":"mp-979289","created_at":"2022-09-04T14:46:56.692393Z","structure_string":"Ta1 W3\n1.0\n0.000000 3.215570 3.215570\n3.215570 0.000000 3.215570\n3.215570 3.215570 0.000000\nTa W\n1 3\ndirect\n0.000000 0.000000 0.000000 Ta\n0.250000 0.250000 0.250000 W\n0.750000 0.750000 0.750000 W\n0.500000 0.500000 0.500000 W\n","nsites":4,"nelements":2,"elements":["Ta","W"],"chemical_system":"Ta-W","density":18.290845529241075,"density_atomic":0.06015283369671962,"volume":66.49728290719139,"volume_molar":10.011399945616214,"formula_full":"Ta1 W3","formula_reduced":"TaW3","formula_anonymous":"AB3","energy":-51.09310345,"energy_per_atom":-12.7732758625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-51.09310345,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0007812,"is_theoretical":true,"updated_at":"2021-11-28T01:37:50.152000Z","spacegroup":225}]}