{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-total_magnetization&page=10250","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-total_magnetization&page=10248","results":[{"id":"mp-696878","created_at":"2022-09-04T14:39:06.105295Z","structure_string":"K3 Ca1 P2 H1 O8\n1.0\n2.906137 4.991273 0.000000\n-2.906137 4.991273 0.000000\n0.000000 0.607040 7.497016\nK Ca P H O\n3 1 2 1 8\ndirect\n0.000000 0.000000 0.500000 K\n0.330307 0.330307 0.190493 K\n0.669693 0.669693 0.809507 K\n0.000000 0.000000 0.000000 Ca\n0.340249 0.340249 0.748614 P\n0.659751 0.659751 0.251386 P\n0.500000 0.500000 0.500000 H\n0.185181 0.185181 0.780911 O\n0.814819 0.814819 0.219089 O\n0.379190 0.379190 0.540223 O\n0.620810 0.620810 0.459777 O\n0.182227 0.620442 0.828272 O\n0.620442 0.182227 0.828272 O\n0.817773 0.379558 0.171728 O\n0.379558 0.817773 0.171728 O\n","nsites":15,"nelements":5,"elements":["K","Ca","P","H","O"],"chemical_system":"Ca-H-K-O-P","density":2.6594149829430225,"density_atomic":0.06896764830445316,"volume":217.49327936750117,"volume_molar":8.73183428470064,"formula_full":"K3 Ca1 P2 H1 O8","formula_reduced":"K3CaP2HO8","formula_anonymous":"ABC2D3E8","energy":-100.00963389,"energy_per_atom":-6.6673089260000005,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-94.51363389,"band_gap":4.9617,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0001596,"is_theoretical":false,"updated_at":"2021-11-28T01:34:42.542000Z","spacegroup":12},{"id":"mp-30343","created_at":"2022-09-04T14:40:17.596154Z","structure_string":"In1 Ag3\n1.0\n4.247110 0.000000 0.000000\n0.000000 4.247110 0.000000\n0.000000 0.000000 4.247110\nIn Ag\n1 3\ndirect\n0.000000 0.000000 0.000000 In\n0.000000 0.500000 0.500000 Ag\n0.500000 0.500000 0.000000 Ag\n0.500000 0.000000 0.500000 Ag\n","nsites":4,"nelements":2,"elements":["In","Ag"],"chemical_system":"Ag-In","density":9.503016923378139,"density_atomic":0.0522130981176812,"volume":76.60912959013744,"volume_molar":11.53377404732222,"formula_full":"In1 Ag3","formula_reduced":"InAg3","formula_anonymous":"AB3","energy":-11.38286783,"energy_per_atom":-2.8457169575,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-11.38286783,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001596,"is_theoretical":false,"updated_at":"2021-11-28T01:35:00.521000Z","spacegroup":221},{"id":"mp-554966","created_at":"2022-09-04T14:44:25.716382Z","structure_string":"Na10 Mo2 N2 O8\n1.0\n2.922882 -4.978071 0.000000\n2.922882 4.978071 0.000000\n0.000000 0.000000 10.840587\nNa Mo N O\n10 2 2 8\ndirect\n0.190909 0.809091 0.500000 Na\n0.190909 0.809091 0.000000 Na\n0.545462 0.168992 0.750000 Na\n0.168992 0.545462 0.750000 Na\n0.500000 0.500000 0.000000 Na\n0.809091 0.190909 0.500000 Na\n0.809091 0.190909 0.000000 Na\n0.500000 0.500000 0.500000 Na\n0.454538 0.831008 0.250000 Na\n0.831008 0.454538 0.250000 Na\n0.207589 0.207589 0.250000 Mo\n0.792411 0.792411 0.750000 Mo\n0.906642 0.906642 0.250000 N\n0.093358 0.093358 0.750000 N\n0.834598 0.559252 0.627125 O\n0.559252 0.834598 0.627125 O\n0.165402 0.440748 0.372875 O\n0.440748 0.165402 0.372875 O\n0.440748 0.165402 0.127125 O\n0.165402 0.440748 0.127125 O\n0.559252 0.834598 0.872875 O\n0.834598 0.559252 0.872875 O\n","nsites":22,"nelements":4,"elements":["Na","Mo","N","O"],"chemical_system":"Mo-N-Na-O","density":3.0413133477316805,"density_atomic":0.06973768343366968,"volume":315.46789220386256,"volume_molar":8.635418418691668,"formula_full":"Na10 Mo2 N2 O8","formula_reduced":"Na5MoNO4","formula_anonymous":"ABC4D5","energy":-126.12612237,"energy_per_atom":-5.733005562272727,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-113.50412237,"band_gap":2.8972,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001596,"is_theoretical":false,"updated_at":"2021-11-28T01:36:21.740000Z","spacegroup":63},{"id":"mp-4852","created_at":"2022-09-04T14:39:22.978018Z","structure_string":"Ni1 Rh2 Se4\n1.0\n1.864282 6.153833 0.000000\n-1.864282 6.153833 0.000000\n0.000000 3.131103 5.579500\nNi Rh Se\n1 2 4\ndirect\n0.000000 0.000000 0.000000 Ni\n0.263976 0.263976 0.717139 Rh\n0.736024 0.736024 0.282861 Rh\n0.368347 0.368347 0.978218 Se\n0.631653 0.631653 0.021782 Se\n0.115728 0.115728 0.551576 Se\n0.884272 0.884272 0.448424 Se\n","nsites":7,"nelements":3,"elements":["Ni","Rh","Se"],"chemical_system":"Ni-Rh-Se","density":7.52752671006213,"density_atomic":0.054678356174064406,"volume":128.02140535673806,"volume_molar":11.013756047875635,"formula_full":"Ni1 Rh2 Se4","formula_reduced":"Ni(RhSe2)2","formula_anonymous":"AB2C4","energy":-38.7365881,"energy_per_atom":-5.5337983,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-36.8485881,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001596,"is_theoretical":false,"updated_at":"2021-11-28T01:34:33.497000Z","spacegroup":12},{"id":"mp-693432","created_at":"2022-09-04T14:44:20.959276Z","structure_string":"Ti4 H4 C2 Se8 Cl32 O10\n1.0\n11.216979 0.000000 0.000000\n0.000000 11.196859 0.000000\n0.000000 8.868533 11.855580\nTi H C Se Cl O\n4 4 2 8 32 10\ndirect\n0.134513 0.582438 0.432304 Ti\n0.134513 0.417562 0.067696 Ti\n0.865487 0.582438 0.932304 Ti\n0.865487 0.417562 0.567696 Ti\n0.150520 0.963011 0.949857 H\n0.150520 0.036989 0.550143 H\n0.849480 0.963011 0.449857 H\n0.849480 0.036989 0.050143 H\n0.077248 0.000000 0.250000 C\n0.922752 0.000000 0.750000 C\n0.664093 0.000935 0.368402 Se\n0.664093 0.999065 0.131598 Se\n0.638639 0.197445 0.152279 Se\n0.638639 0.802555 0.347721 Se\n0.361361 0.197445 0.652279 Se\n0.361361 0.802555 0.847721 Se\n0.335907 0.000935 0.868402 Se\n0.335907 0.999065 0.631598 Se\n0.594061 0.623172 0.281077 Cl\n0.594061 0.376828 0.218923 Cl\n0.693459 0.651740 0.949562 Cl\n0.693459 0.348260 0.550438 Cl\n0.635076 0.028974 0.804948 Cl\n0.635076 0.971026 0.695052 Cl\n0.367645 0.834410 0.077097 Cl\n0.367645 0.165590 0.422903 Cl\n0.804770 0.575360 0.599540 Cl\n0.804770 0.424640 0.900460 Cl\n0.745481 0.282127 0.351768 Cl\n0.745481 0.717873 0.148232 Cl\n0.925612 0.420376 0.118136 Cl\n0.925612 0.579624 0.381864 Cl\n0.901499 0.180170 0.477396 Cl\n0.901499 0.819830 0.022604 Cl\n0.098501 0.180170 0.977396 Cl\n0.098501 0.819830 0.522604 Cl\n0.074388 0.420376 0.618136 Cl\n0.074388 0.579624 0.881864 Cl\n0.254519 0.282127 0.851768 Cl\n0.254519 0.717873 0.648232 Cl\n0.195230 0.575360 0.099540 Cl\n0.195230 0.424640 0.400460 Cl\n0.632355 0.834410 0.577097 Cl\n0.632355 0.165590 0.922903 Cl\n0.364924 0.028974 0.304948 Cl\n0.364924 0.971026 0.195052 Cl\n0.306541 0.651740 0.449562 Cl\n0.306541 0.348260 0.050438 Cl\n0.405939 0.623172 0.781077 Cl\n0.405939 0.376828 0.718923 Cl\n0.076558 0.125058 0.217979 O\n0.076558 0.874942 0.282021 O\n0.173746 0.983031 0.877400 O\n0.173746 0.016969 0.622600 O\n0.854945 0.500000 0.750000 O\n0.145055 0.500000 0.250000 O\n0.826254 0.983031 0.377400 O\n0.826254 0.016969 0.122600 O\n0.923442 0.125058 0.717979 O\n0.923442 0.874942 0.782021 O\n","nsites":60,"nelements":6,"elements":["Ti","H","C","Se","Cl","O"],"chemical_system":"C-Cl-H-O-Se-Ti","density":2.392882579204777,"density_atomic":0.04029547957620211,"volume":1489.0007671092487,"volume_molar":14.944953685466457,"formula_full":"Ti4 H4 C2 Se8 Cl32 O10","formula_reduced":"Ti2H2CSe4Cl16O5","formula_anonymous":"AB2C2D4E5F16","energy":-258.56633632,"energy_per_atom":-4.309438938666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-232.04833632,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001596,"is_theoretical":true,"updated_at":"2021-11-28T01:36:38.179000Z","spacegroup":13},{"id":"mp-1227128","created_at":"2022-09-04T14:46:52.762582Z","structure_string":"Ca1 Mg2 Al6 O12\n1.0\n0.000000 0.000000 -2.830897\n-4.416587 -7.649795 0.000000\n-4.416601 7.649803 0.000000\nCa Mg Al O\n1 2 6 12\ndirect\n0.750000 0.999999 0.999999 Ca\n0.750000 0.333337 0.666670 Mg\n0.250000 0.666662 0.333329 Mg\n0.750000 0.643412 0.656039 Al\n0.750000 0.343960 0.987373 Al\n0.750000 0.012626 0.356586 Al\n0.250000 0.354409 0.345280 Al\n0.250000 0.654721 0.009127 Al\n0.250000 0.990872 0.645594 Al\n0.750000 0.108846 0.799322 O\n0.750000 0.200673 0.309523 O\n0.750000 0.690476 0.891153 O\n0.250000 0.898431 0.189941 O\n0.250000 0.810065 0.708495 O\n0.250000 0.291510 0.101570 O\n0.750000 0.533240 0.401563 O\n0.750000 0.598437 0.131675 O\n0.750000 0.868324 0.466760 O\n0.250000 0.468753 0.598359 O\n0.250000 0.401642 0.870394 O\n0.250000 0.129606 0.531248 O\n","nsites":21,"nelements":4,"elements":["Ca","Mg","Al","O"],"chemical_system":"Al-Ca-Mg-O","density":3.8418422996808257,"density_atomic":0.10978113805984667,"volume":191.28969120862956,"volume_molar":5.4855878399776286,"formula_full":"Ca1 Mg2 Al6 O12","formula_reduced":"CaMg2Al6O12","formula_anonymous":"AB2C6D12","energy":-156.77019226,"energy_per_atom":-7.46524725047619,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-148.52619226,"band_gap":3.2783,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001596,"is_theoretical":true,"updated_at":"2021-11-28T01:37:42.309000Z","spacegroup":174},{"id":"mp-1186652","created_at":"2022-09-04T14:42:51.801454Z","structure_string":"Pm1 Sm1 Rh2\n1.0\n0.000000 3.512770 3.512770\n3.512770 0.000000 3.512770\n3.512770 3.512770 0.000000\nPm Sm Rh\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Pm\n0.000000 0.000000 0.000000 Sm\n0.250000 0.250000 0.250000 Rh\n0.750000 0.750000 0.750000 Rh\n","nsites":4,"nelements":3,"elements":["Pm","Sm","Rh"],"chemical_system":"Pm-Rh-Sm","density":9.599660834627407,"density_atomic":0.04614034636031487,"volume":86.69202369578188,"volume_molar":13.051789236631349,"formula_full":"Pm1 Sm1 Rh2","formula_reduced":"PmSmRh2","formula_anonymous":"ABC2","energy":-27.01144416,"energy_per_atom":-6.75286104,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-27.01144416,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001595,"is_theoretical":true,"updated_at":"2021-11-28T01:35:57.945000Z","spacegroup":225},{"id":"mp-1120732","created_at":"2022-09-04T14:39:31.267162Z","structure_string":"V1 In3 S4\n1.0\n-3.735043 3.735043 3.735043\n3.735043 -3.735043 3.735043\n3.735043 3.735043 -3.735043\nV In S\n1 3 4\ndirect\n0.000000 0.000000 0.000000 V\n0.500000 0.500000 0.000000 In\n0.000000 0.500000 0.500000 In\n0.500000 0.000000 0.500000 In\n0.334776 0.000000 0.000000 S\n0.000000 0.000000 0.334776 S\n0.665224 0.665224 0.665224 S\n0.000000 0.334776 0.000000 S\n","nsites":8,"nelements":3,"elements":["V","In","S"],"chemical_system":"In-S-V","density":4.172035136581711,"density_atomic":0.03838337663879158,"volume":208.42355989897254,"volume_molar":15.6894501926488,"formula_full":"V1 In3 S4","formula_reduced":"VIn3S4","formula_anonymous":"AB3C4","energy":-39.99413016,"energy_per_atom":-4.99926627,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-37.98213016,"band_gap":1.5702000000000005,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001595,"is_theoretical":true,"updated_at":"2021-11-28T01:34:29.299000Z","spacegroup":217},{"id":"mp-557112","created_at":"2022-09-04T14:40:24.479227Z","structure_string":"Li8 Ga6 Si6 I2 O24\n1.0\n8.741057 0.000000 0.000000\n0.000000 8.741057 0.000000\n0.000000 0.000000 8.741057\nLi Ga Si I O\n8 6 6 2 24\ndirect\n0.188981 0.811019 0.811019 Li\n0.811019 0.188981 0.811019 Li\n0.688981 0.311019 0.311019 Li\n0.188981 0.188981 0.188981 Li\n0.811019 0.811019 0.188981 Li\n0.688981 0.688981 0.688981 Li\n0.311019 0.311019 0.688981 Li\n0.311019 0.688981 0.311019 Li\n0.000000 0.750000 0.500000 Ga\n0.250000 0.500000 0.000000 Ga\n0.500000 0.000000 0.750000 Ga\n0.500000 0.000000 0.250000 Ga\n0.000000 0.250000 0.500000 Ga\n0.750000 0.500000 0.000000 Ga\n0.000000 0.500000 0.250000 Si\n0.500000 0.750000 0.000000 Si\n0.500000 0.250000 0.000000 Si\n0.000000 0.500000 0.750000 Si\n0.750000 0.000000 0.500000 Si\n0.250000 0.000000 0.500000 Si\n0.000000 0.000000 0.000000 I\n0.500000 0.500000 0.500000 I\n0.130002 0.591310 0.851366 O\n0.091310 0.630002 0.351366 O\n0.408690 0.851366 0.869998 O\n0.408690 0.148634 0.130002 O\n0.148634 0.869998 0.591310 O\n0.591310 0.851366 0.130002 O\n0.351366 0.091310 0.630002 O\n0.908690 0.369998 0.351366 O\n0.591310 0.148634 0.869998 O\n0.369998 0.648634 0.091310 O\n0.351366 0.908690 0.369998 O\n0.091310 0.369998 0.648634 O\n0.869998 0.591310 0.148634 O\n0.648634 0.908690 0.630002 O\n0.908690 0.630002 0.648634 O\n0.869998 0.408690 0.851366 O\n0.630002 0.351366 0.091310 O\n0.648634 0.091310 0.369998 O\n0.851366 0.869998 0.408690 O\n0.369998 0.351366 0.908690 O\n0.148634 0.130002 0.408690 O\n0.130002 0.408690 0.148634 O\n0.630002 0.648634 0.908690 O\n0.851366 0.130002 0.591310 O\n","nsites":46,"nelements":5,"elements":["Li","Ga","Si","I","O"],"chemical_system":"Ga-I-Li-O-Si","density":3.182922668064786,"density_atomic":0.06887569194154942,"volume":667.8698783750497,"volume_molar":8.74349221073615,"formula_full":"Li8 Ga6 Si6 I2 O24","formula_reduced":"Li4Ga3Si3IO12","formula_anonymous":"AB3C3D4E12","energy":-311.21939595,"energy_per_atom":-6.765639042391304,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-293.97339595,"band_gap":3.4396999999999998,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001595,"is_theoretical":false,"updated_at":"2021-11-28T01:35:06.449000Z","spacegroup":218},{"id":"mp-1256211","created_at":"2022-09-04T14:41:07.696484Z","structure_string":"Mg2 Ti2 Si2 O10\n1.0\n3.222783 -0.054264 4.371261\n2.828753 -6.503898 0.148636\n-0.193660 0.099284 -8.591492\nMg Ti Si O\n2 2 2 10\ndirect\n0.445995 0.297669 0.160048 Mg\n0.540585 0.737512 0.846237 Mg\n0.506082 0.500876 0.513110 Ti\n0.494841 0.002178 0.489991 Ti\n0.489069 0.230902 0.811120 Si\n0.513672 0.744977 0.189038 Si\n0.169046 0.155119 0.526195 O\n0.681729 0.379716 0.811223 O\n0.824480 0.825716 0.468344 O\n0.327134 0.595233 0.193880 O\n0.824390 0.603751 0.198818 O\n0.112335 0.933505 0.893827 O\n0.187120 0.368006 0.807885 O\n0.890279 0.026093 0.091808 O\n0.526178 0.736546 0.601625 O\n0.467695 0.240248 0.398830 O\n","nsites":16,"nelements":4,"elements":["Mg","Ti","Si","O"],"chemical_system":"Mg-O-Si-Ti","density":3.4317705708585953,"density_atomic":0.09172189516878836,"volume":174.44035549588787,"volume_molar":6.565652343879227,"formula_full":"Mg2 Ti2 Si2 O10","formula_reduced":"MgTiSiO5","formula_anonymous":"ABCD5","energy":-131.64023124,"energy_per_atom":-8.2275144525,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-124.77023124,"band_gap":2.8925999999999994,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0001595,"is_theoretical":true,"updated_at":"2021-11-28T01:35:09.734000Z","spacegroup":1},{"id":"mp-22664","created_at":"2022-09-04T14:45:29.308130Z","structure_string":"Ho1 Rh3 C1\n1.0\n4.173791 0.000000 0.000000\n0.000000 4.173791 0.000000\n0.000000 0.000000 4.173791\nHo Rh C\n1 3 1\ndirect\n0.000000 0.000000 0.000000 Ho\n0.000000 0.500000 0.500000 Rh\n0.500000 0.500000 0.000000 Rh\n0.500000 0.000000 0.500000 Rh\n0.500000 0.500000 0.500000 C\n","nsites":5,"nelements":3,"elements":["Ho","Rh","C"],"chemical_system":"C-Ho-Rh","density":11.091419219911343,"density_atomic":0.0687666565870926,"volume":72.70965680391232,"volume_molar":8.757355757689034,"formula_full":"Ho1 Rh3 C1","formula_reduced":"HoRh3C","formula_anonymous":"ABC3","energy":-38.48704197,"energy_per_atom":-7.697408394,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-38.48704197,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001595,"is_theoretical":false,"updated_at":"2021-11-28T01:37:03.789000Z","spacegroup":221},{"id":"mp-850131","created_at":"2022-09-04T14:47:15.757868Z","structure_string":"Ni2 S4\n1.0\n5.350663 0.000000 0.000000\n0.000000 3.760921 0.000000\n0.000000 2.770592 4.688609\nNi S\n2 4\ndirect\n0.000000 0.500000 0.500000 Ni\n0.500000 0.500000 0.000000 Ni\n0.113913 0.668439 0.820508 S\n0.386087 0.668439 0.320508 S\n0.886087 0.331561 0.179492 S\n0.613913 0.331561 0.679492 S\n","nsites":6,"nelements":2,"elements":["Ni","S"],"chemical_system":"Ni-S","density":4.323290135292187,"density_atomic":0.06359243047345936,"volume":94.35085206413257,"volume_molar":9.469901865935714,"formula_full":"Ni2 S4","formula_reduced":"NiS2","formula_anonymous":"AB2","energy":-31.52883821,"energy_per_atom":-5.254806368333333,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-29.516838210000003,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001595,"is_theoretical":true,"updated_at":"2021-11-28T01:38:05.447000Z","spacegroup":14}]}