{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-total_magnetization&page=10219","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-total_magnetization&page=10217","results":[{"id":"mp-568796","created_at":"2022-09-04T14:46:55.572542Z","structure_string":"Rb4 Yb4 I12\n1.0\n4.671269 0.000000 0.000000\n0.000000 10.634300 0.000000\n0.000000 0.000000 17.508340\nRb Yb I\n4 4 12\ndirect\n0.750000 0.573160 0.178940 Rb\n0.250000 0.426840 0.821060 Rb\n0.250000 0.926840 0.678940 Rb\n0.750000 0.073160 0.321060 Rb\n0.750000 0.331830 0.554456 Yb\n0.750000 0.831830 0.945544 Yb\n0.250000 0.168170 0.054456 Yb\n0.250000 0.668170 0.445544 Yb\n0.250000 0.018275 0.896680 I\n0.750000 0.204888 0.711595 I\n0.750000 0.704888 0.788405 I\n0.250000 0.666255 0.011033 I\n0.250000 0.295112 0.211595 I\n0.750000 0.333745 0.988967 I\n0.250000 0.518275 0.603320 I\n0.750000 0.833745 0.511033 I\n0.750000 0.981725 0.103320 I\n0.750000 0.481725 0.396680 I\n0.250000 0.166255 0.488967 I\n0.250000 0.795112 0.288405 I\n","nsites":20,"nelements":3,"elements":["Rb","Yb","I"],"chemical_system":"I-Rb-Yb","density":4.881704743432991,"density_atomic":0.022995414313514866,"volume":869.7386238544786,"volume_molar":26.18844208630182,"formula_full":"Rb4 Yb4 I12","formula_reduced":"RbYbI3","formula_anonymous":"ABC3","energy":-64.94999951999999,"energy_per_atom":-3.2474999759999994,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-60.40199952,"band_gap":3.6062,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0001674,"is_theoretical":false,"updated_at":"2021-11-28T01:37:48.101000Z","spacegroup":62},{"id":"mp-1204388","created_at":"2022-09-04T14:39:39.876978Z","structure_string":"La8 Mo8 Cl8 O32\n1.0\n5.903185 0.000000 0.000000\n0.000000 8.076672 0.000000\n0.000000 0.000885 19.423280\nLa Mo Cl O\n8 8 8 32\ndirect\n0.699449 0.373148 0.104432 La\n0.199449 0.126852 0.895568 La\n0.300551 0.626852 0.895568 La\n0.800551 0.873148 0.104432 La\n0.700941 0.377675 0.604628 La\n0.200941 0.122325 0.395372 La\n0.299059 0.622325 0.395372 La\n0.799059 0.877675 0.604628 La\n0.748036 0.409973 0.821440 Mo\n0.248036 0.090027 0.178560 Mo\n0.251964 0.590027 0.178560 Mo\n0.751964 0.909973 0.821440 Mo\n0.756268 0.340960 0.321151 Mo\n0.256268 0.159040 0.678849 Mo\n0.243732 0.659040 0.678849 Mo\n0.743732 0.840960 0.321151 Mo\n0.760240 0.124420 0.988587 Cl\n0.260240 0.375580 0.011413 Cl\n0.239760 0.875580 0.011413 Cl\n0.739760 0.624420 0.988587 Cl\n0.759498 0.126991 0.488537 Cl\n0.259498 0.373009 0.511463 Cl\n0.240502 0.873009 0.511463 Cl\n0.740502 0.626991 0.488537 Cl\n0.766682 0.374014 0.731324 O\n0.266682 0.125986 0.268676 O\n0.233318 0.625986 0.268676 O\n0.733318 0.874014 0.731324 O\n0.814173 0.128696 0.827718 O\n0.314173 0.371304 0.172282 O\n0.185827 0.871304 0.172282 O\n0.685827 0.628696 0.827718 O\n0.986184 0.152651 0.134976 O\n0.486184 0.347349 0.865024 O\n0.013816 0.847349 0.865024 O\n0.513816 0.652651 0.134976 O\n0.520300 0.100180 0.132603 O\n0.020300 0.399820 0.867397 O\n0.479700 0.899820 0.867397 O\n0.979700 0.600180 0.132603 O\n0.760145 0.379514 0.231270 O\n0.260145 0.120486 0.768730 O\n0.239855 0.620486 0.768730 O\n0.739855 0.879514 0.231270 O\n0.816138 0.121843 0.327098 O\n0.316138 0.378157 0.672902 O\n0.183862 0.878157 0.672902 O\n0.683862 0.621843 0.327098 O\n0.979263 0.150222 0.635504 O\n0.479263 0.349778 0.364496 O\n0.020737 0.849778 0.364496 O\n0.520737 0.650222 0.635504 O\n0.513142 0.097018 0.632379 O\n0.013142 0.402982 0.367621 O\n0.486858 0.902982 0.367621 O\n0.986858 0.597018 0.632379 O\n","nsites":56,"nelements":4,"elements":["La","Mo","Cl","O"],"chemical_system":"Cl-La-Mo-O","density":4.795445334505783,"density_atomic":0.060470925592638045,"volume":926.0648725181354,"volume_molar":9.958737527135119,"formula_full":"La8 Mo8 Cl8 O32","formula_reduced":"LaMoClO4","formula_anonymous":"ABCD4","energy":-451.35687285,"energy_per_atom":-8.059944158035714,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-398.84487285,"band_gap":2.7474000000000003,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0001673,"is_theoretical":false,"updated_at":"2021-11-28T01:34:23.802000Z","spacegroup":14},{"id":"mp-756667","created_at":"2022-09-04T14:42:48.824507Z","structure_string":"Li4 Ni4 P4 O16\n1.0\n-1.059666 -0.360917 5.860547\n6.376321 -0.029545 0.035121\n2.632671 8.976258 0.085329\nLi Ni P O\n4 4 4 16\ndirect\n0.596030 0.170397 0.267700 Li\n0.404102 0.829227 0.732215 Li\n0.431121 0.339388 0.670493 Li\n0.568592 0.660230 0.329392 Li\n0.013606 0.923163 0.284457 Ni\n0.804629 0.354936 0.933057 Ni\n0.986387 0.076743 0.715744 Ni\n0.195570 0.645527 0.066720 Ni\n0.161192 0.283192 0.379268 P\n0.838551 0.716878 0.620681 P\n0.284970 0.181654 0.999035 P\n0.715331 0.818440 0.001039 P\n0.530310 0.258507 0.051137 O\n0.470130 0.741458 0.948797 O\n0.304955 0.107007 0.365850 O\n0.695250 0.893473 0.634011 O\n0.918982 0.210360 0.314807 O\n0.080856 0.789178 0.685244 O\n0.803014 0.048526 0.894458 O\n0.197337 0.951599 0.105667 O\n0.131550 0.350828 0.010031 O\n0.868726 0.649219 0.990138 O\n0.162344 0.289199 0.544194 O\n0.837381 0.710585 0.455817 O\n0.274635 0.165922 0.836231 O\n0.725444 0.834011 0.163858 O\n0.729886 0.480853 0.710170 O\n0.269119 0.519501 0.289790 O\n","nsites":28,"nelements":4,"elements":["Li","Ni","P","O"],"chemical_system":"Li-Ni-O-P","density":3.1712544758704087,"density_atomic":0.08323747806912418,"volume":336.38693350064653,"volume_molar":7.234890940591617,"formula_full":"Li4 Ni4 P4 O16","formula_reduced":"LiNiPO4","formula_anonymous":"ABCD4","energy":-195.94664057,"energy_per_atom":-6.998094306071429,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-174.79064057,"band_gap":3.3747,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.0001673,"is_theoretical":true,"updated_at":"2021-11-28T01:35:48.842000Z","spacegroup":2},{"id":"mp-11014","created_at":"2022-09-04T14:43:34.446227Z","structure_string":"K4 Te2 O2 F8\n1.0\n3.218864 -7.147536 0.000000\n3.218864 7.147536 0.000000\n0.000000 0.000000 6.721015\nK Te O F\n4 2 2 8\ndirect\n0.426957 0.573043 0.250000 K\n0.573043 0.426957 0.750000 K\n0.750472 0.249528 0.250000 K\n0.249528 0.750472 0.750000 K\n0.110023 0.889977 0.250000 Te\n0.889977 0.110023 0.750000 Te\n0.762845 0.237155 0.750000 O\n0.237155 0.762845 0.250000 O\n0.122983 0.347596 0.532584 F\n0.347596 0.122983 0.467416 F\n0.122983 0.347596 0.967416 F\n0.347596 0.122983 0.032584 F\n0.877017 0.652404 0.032584 F\n0.652404 0.877017 0.967416 F\n0.652404 0.877017 0.532584 F\n0.877017 0.652404 0.467416 F\n","nsites":16,"nelements":4,"elements":["K","Te","O","F"],"chemical_system":"F-K-O-Te","density":3.197899408524932,"density_atomic":0.05173639254918461,"volume":309.2600626297855,"volume_molar":11.640047678768651,"formula_full":"K4 Te2 O2 F8","formula_reduced":"K2TeOF4","formula_anonymous":"ABC2D4","energy":-77.64517033000001,"energy_per_atom":-4.852823145625001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-72.57517033,"band_gap":4.8881,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001673,"is_theoretical":false,"updated_at":"2021-11-28T01:36:18.939000Z","spacegroup":63},{"id":"mp-29198","created_at":"2022-09-04T14:47:13.177525Z","structure_string":"Na10 Au2 Se24\n1.0\n17.200485 0.000000 0.000000\n0.000000 7.225209 0.000000\n0.000000 2.411733 8.121009\nNa Au Se\n10 2 24\ndirect\n0.353363 0.777460 0.349069 Na\n0.853363 0.222540 0.650931 Na\n0.937935 0.779867 0.017747 Na\n0.437935 0.220133 0.982253 Na\n0.070907 0.293150 0.441678 Na\n0.570907 0.706850 0.558322 Na\n0.761390 0.663545 0.286811 Na\n0.261390 0.336455 0.713189 Na\n0.139018 0.878768 0.102724 Na\n0.639018 0.121232 0.897276 Na\n0.850128 0.216237 0.158947 Au\n0.350128 0.783763 0.841053 Au\n0.787698 0.009724 0.423951 Se\n0.545832 0.951296 0.212252 Se\n0.720472 0.388221 0.081047 Se\n0.220472 0.611779 0.918953 Se\n0.980980 0.048249 0.246776 Se\n0.480980 0.951751 0.753224 Se\n0.911415 0.424995 0.893785 Se\n0.287698 0.990276 0.576049 Se\n0.448935 0.216399 0.517441 Se\n0.411415 0.575005 0.106215 Se\n0.751934 0.634557 0.832037 Se\n0.251934 0.365443 0.167963 Se\n0.948935 0.783601 0.482559 Se\n0.187723 0.605585 0.422068 Se\n0.661936 0.155790 0.435858 Se\n0.161936 0.844210 0.564142 Se\n0.043623 0.312099 0.904646 Se\n0.543623 0.687901 0.095354 Se\n0.780743 0.903535 0.934630 Se\n0.280743 0.096465 0.065370 Se\n0.927847 0.525909 0.362804 Se\n0.427847 0.474091 0.637196 Se\n0.687723 0.394415 0.577932 Se\n0.045832 0.048704 0.787748 Se\n","nsites":36,"nelements":3,"elements":["Na","Au","Se"],"chemical_system":"Au-Na-Se","density":4.144325860220051,"density_atomic":0.03566985976430765,"volume":1009.2554396870015,"volume_molar":16.88299533497448,"formula_full":"Na10 Au2 Se24","formula_reduced":"Na5AuSe12","formula_anonymous":"AB5C12","energy":-133.15076213999998,"energy_per_atom":-3.6986322816666664,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-121.82276214,"band_gap":1.0246000000000002,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001673,"is_theoretical":false,"updated_at":"2021-11-28T01:38:00.412000Z","spacegroup":4},{"id":"mp-19845","created_at":"2022-09-04T14:40:38.948748Z","structure_string":"Ti1 Pb1 O3\n1.0\n3.969049 0.000000 0.000000\n0.000000 3.969049 0.000000\n0.000000 0.000000 3.969049\nTi Pb O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Pb\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.000000 0.500000 0.500000 O\n","nsites":5,"nelements":3,"elements":["Ti","Pb","O"],"chemical_system":"O-Pb-Ti","density":8.048700857425851,"density_atomic":0.0799669667043618,"volume":62.52581792285582,"volume_molar":7.530785533311372,"formula_full":"Ti1 Pb1 O3","formula_reduced":"TiPbO3","formula_anonymous":"ABC3","energy":-39.8988623,"energy_per_atom":-7.9797724599999995,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-37.8378623,"band_gap":1.585,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001673,"is_theoretical":false,"updated_at":"2021-11-28T01:35:06.549000Z","spacegroup":221},{"id":"mp-1341203","created_at":"2022-09-04T14:48:25.458172Z","structure_string":"Ti8 O16\n1.0\n5.184534 0.000000 0.000000\n0.000000 5.987927 0.000000\n0.000000 0.000000 10.675797\nTi O\n8 16\ndirect\n0.493201 0.500000 0.237155 Ti\n0.493201 0.500000 0.762845 Ti\n0.506799 0.000000 0.262845 Ti\n0.506799 0.000000 0.737155 Ti\n0.000000 0.250000 0.250000 Ti\n0.000000 0.750000 0.750000 Ti\n0.000000 0.750000 0.250000 Ti\n0.000000 0.250000 0.750000 Ti\n0.832818 0.500000 0.157561 O\n0.832818 0.500000 0.842439 O\n0.167182 0.000000 0.342439 O\n0.167182 0.000000 0.657561 O\n0.166500 0.500000 0.338889 O\n0.166500 0.500000 0.661111 O\n0.833500 0.000000 0.161111 O\n0.833500 0.000000 0.838889 O\n0.666921 0.250281 0.341395 O\n0.666921 0.749719 0.658605 O\n0.333079 0.750281 0.158605 O\n0.333079 0.249719 0.841395 O\n0.333079 0.249719 0.158605 O\n0.333079 0.750281 0.841395 O\n0.666921 0.749719 0.341395 O\n0.666921 0.250281 0.658605 O\n","nsites":24,"nelements":2,"elements":["Ti","O"],"chemical_system":"O-Ti","density":3.2012043588992443,"density_atomic":0.07241436230831812,"volume":331.4259662719306,"volume_molar":8.316224251702412,"formula_full":"Ti8 O16","formula_reduced":"TiO2","formula_anonymous":"AB2","energy":-222.74705571,"energy_per_atom":-9.28112732125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-211.75505571,"band_gap":2.5137,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001672,"is_theoretical":true,"updated_at":"2021-11-28T01:39:37.436000Z","spacegroup":59},{"id":"mp-615682","created_at":"2022-09-04T14:39:41.259386Z","structure_string":"Ba2 La1 Ta1 Cu2 O8\n1.0\n3.999601 0.000000 0.000000\n0.000000 3.999601 0.000000\n0.000000 0.000000 12.232326\nBa La Ta Cu O\n2 1 1 2 8\ndirect\n0.000000 0.000000 0.194808 Ba\n0.000000 0.000000 0.805192 Ba\n0.000000 0.000000 0.500000 La\n0.500000 0.500000 0.000000 Ta\n0.500000 0.500000 0.640637 Cu\n0.500000 0.500000 0.359363 Cu\n0.500000 0.500000 0.162085 O\n0.000000 0.500000 0.628023 O\n0.500000 0.000000 0.628023 O\n0.500000 0.000000 0.371977 O\n0.000000 0.500000 0.371977 O\n0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.837915 O\n0.500000 0.000000 0.000000 O\n","nsites":14,"nelements":5,"elements":["Ba","La","Ta","Cu","O"],"chemical_system":"Ba-Cu-La-O-Ta","density":7.209720552937877,"density_atomic":0.07154604844756329,"volume":195.67817236280658,"volume_molar":8.417153554488307,"formula_full":"Ba2 La1 Ta1 Cu2 O8","formula_reduced":"Ba2LaTa(CuO4)2","formula_anonymous":"ABC2D2E8","energy":-107.30208044,"energy_per_atom":-7.664434317142857,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-101.80608044,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001672,"is_theoretical":false,"updated_at":"2021-11-28T01:34:31.486000Z","spacegroup":123},{"id":"mp-1187388","created_at":"2022-09-04T14:44:29.095069Z","structure_string":"Tb1 Tm1 Ir2\n1.0\n0.000000 3.415196 3.415196\n3.415196 0.000000 3.415196\n3.415196 3.415196 0.000000\nTb Tm Ir\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Tb\n0.000000 0.000000 0.000000 Tm\n0.250000 0.250000 0.250000 Ir\n0.750000 0.750000 0.750000 Ir\n","nsites":4,"nelements":3,"elements":["Tb","Tm","Ir"],"chemical_system":"Ir-Tb-Tm","density":14.846744002806256,"density_atomic":0.05020917625226486,"volume":79.6667123137589,"volume_molar":11.994103885997033,"formula_full":"Tb1 Tm1 Ir2","formula_reduced":"TbTmIr2","formula_anonymous":"ABC2","energy":-30.23974958,"energy_per_atom":-7.559937395,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-30.23974958,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001672,"is_theoretical":true,"updated_at":"2021-11-28T01:36:32.671000Z","spacegroup":225},{"id":"mp-1180256","created_at":"2022-09-04T14:41:05.868780Z","structure_string":"Nd3 In3 Ni3\n1.0\n7.884715 0.045207 0.000022\n-3.903208 6.847466 0.000053\n0.000008 0.000031 3.793971\nNd In Ni\n3 3 3\ndirect\n0.331275 0.331343 0.500009 Nd\n0.671290 0.001399 0.500003 Nd\n0.001407 0.671384 0.500004 Nd\n0.664006 0.664001 0.999949 In\n0.336462 0.000159 0.000028 In\n0.000143 0.336468 0.999989 In\n0.998541 0.998496 0.000013 Ni\n0.665107 0.331821 0.000004 Ni\n0.331870 0.665029 0.000002 Ni\n","nsites":9,"nelements":3,"elements":["Nd","In","Ni"],"chemical_system":"In-Nd-Ni","density":7.702533765075395,"density_atomic":0.043794095570307084,"volume":205.50715530935878,"volume_molar":13.751033516223776,"formula_full":"Nd3 In3 Ni3","formula_reduced":"NdInNi","formula_anonymous":"ABC","energy":-42.8387712,"energy_per_atom":-4.759863466666666,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-42.8387712,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001672,"is_theoretical":true,"updated_at":"2021-11-28T01:35:12.919000Z","spacegroup":187},{"id":"mp-1097591","created_at":"2022-09-04T14:43:17.155919Z","structure_string":"Mg2 In1 Ag1\n1.0\n-5.547087 5.964026 8.437897\n5.547087 -5.964026 8.437897\n5.547087 5.964026 -8.437897\nMg In Ag\n2 1 1\ndirect\n0.000000 0.237919 0.237919 Mg\n0.000000 0.762081 0.762081 Mg\n0.000000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 Ag\n","nsites":4,"nelements":3,"elements":["Mg","In","Ag"],"chemical_system":"Ag-In-Mg","density":0.4034540614051749,"density_atomic":0.00358229440562055,"volume":1116.602810121937,"volume_molar":168.10848238914642,"formula_full":"Mg2 In1 Ag1","formula_reduced":"Mg2InAg","formula_anonymous":"ABC2","energy":-4.29273541,"energy_per_atom":-1.0731838525,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-4.29273541,"band_gap":0.0488999999999997,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001671,"is_theoretical":true,"updated_at":"2021-11-28T01:36:10.083000Z","spacegroup":71},{"id":"mp-1105042","created_at":"2022-09-04T14:45:39.026615Z","structure_string":"Dy5 Co2 B6\n1.0\n-2.695065 -4.667990 0.000000\n2.695065 -4.667990 0.000000\n0.000000 -3.111993 7.800100\nDy Co B\n5 2 6\ndirect\n0.000000 0.000000 0.000000 Dy\n0.250757 0.250757 0.247729 Dy\n0.749243 0.749243 0.752271 Dy\n0.416893 0.416893 0.749320 Dy\n0.583107 0.583107 0.250680 Dy\n0.119830 0.119830 0.640510 Co\n0.880170 0.880170 0.359490 Co\n0.168500 0.831500 0.500000 B\n0.831500 0.500000 0.500000 B\n0.500000 0.168500 0.500000 B\n0.168500 0.500000 0.500000 B\n0.500000 0.831500 0.500000 B\n0.831500 0.168500 0.500000 B\n","nsites":13,"nelements":3,"elements":["Dy","Co","B"],"chemical_system":"B-Co-Dy","density":8.420623930963398,"density_atomic":0.06623903930804904,"volume":196.25888502915384,"volume_molar":9.091527931124778,"formula_full":"Dy5 Co2 B6","formula_reduced":"Dy5(CoB3)2","formula_anonymous":"A2B5C6","energy":-84.24758244,"energy_per_atom":-6.480583264615385,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-84.24758244,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001671,"is_theoretical":false,"updated_at":"2021-11-28T01:37:03.352000Z","spacegroup":166}]}