{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=formation_energy_per_atom&page=68","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=formation_energy_per_atom&page=66","results":[{"id":"mp-772324","created_at":"2022-09-04T14:41:01.717636Z","structure_string":"Li6 Mg2 Ni6 O16\n1.0\n-4.257398 -2.432700 0.042054\n4.280531 -4.171308 4.809264\n-1.545254 5.817034 4.896578\nLi Mg Ni O\n6 2 6 16\ndirect\n0.994377 0.885770 0.615986 Li\n0.994329 0.385673 0.116048 Li\n0.501702 0.506237 0.998597 Li\n0.501635 0.006161 0.498644 Li\n0.504262 0.739767 0.767685 Li\n0.504228 0.239778 0.267662 Li\n0.498730 0.126018 0.875529 Mg\n0.498948 0.626125 0.375536 Mg\n0.998023 0.253207 0.749055 Ni\n0.500047 0.876729 0.129730 Ni\n0.998081 0.001773 0.003400 Ni\n0.998296 0.753449 0.249278 Ni\n0.499733 0.376381 0.629558 Ni\n0.998056 0.501587 0.503394 Ni\n0.208762 0.244446 0.979584 O\n0.209052 0.744487 0.479820 O\n0.772684 0.519769 0.247769 O\n0.772347 0.019644 0.747806 O\n0.256562 0.153055 0.643021 O\n0.257206 0.653766 0.143348 O\n0.742700 0.864111 0.348127 O\n0.742290 0.363749 0.847978 O\n0.757608 0.770690 0.027505 O\n0.757320 0.270460 0.527420 O\n0.253667 0.477612 0.742316 O\n0.253812 0.977767 0.242404 O\n0.262447 0.389578 0.408357 O\n0.262450 0.889603 0.908455 O\n0.735959 0.101935 0.111620 O\n0.735608 0.601523 0.611402 O\n","nsites":30,"nelements":4,"elements":["Li","Mg","Ni","O"],"chemical_system":"Li-Mg-Ni-O","density":4.203366469602979,"density_atomic":0.1087328955899103,"volume":275.9054639098915,"volume_molar":5.538471800394889,"formula_full":"Li6 Mg2 Ni6 O16","formula_reduced":"Li3MgNi3O8","formula_anonymous":"AB3C3D8","energy":-174.89944293,"energy_per_atom":-5.829981430999999,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-148.66144293,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.000173,"is_theoretical":true,"updated_at":"2021-11-28T01:35:10.714000Z","spacegroup":3},{"id":"mp-999460","created_at":"2022-09-04T14:41:04.071507Z","structure_string":"Na1 Sc1 S2\n1.0\n6.714610 -1.884894 0.000000\n6.714610 1.884894 0.000000\n6.185491 0.000000 3.221570\nNa Sc S\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sc\n0.738810 0.738810 0.738810 S\n0.261190 0.261190 0.261190 S\n","nsites":4,"nelements":3,"elements":["Na","Sc","S"],"chemical_system":"Na-S-Sc","density":2.689469751278976,"density_atomic":0.04905177171329539,"volume":81.54649384286782,"volume_molar":12.277111610155583,"formula_full":"Na1 Sc1 S2","formula_reduced":"NaScS2","formula_anonymous":"ABC2","energy":-23.89119934,"energy_per_atom":-5.972799835,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-22.88519934,"band_gap":1.6857000000000002,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.2e-06,"is_theoretical":false,"updated_at":"2021-11-28T01:35:11.859000Z","spacegroup":166},{"id":"mp-1105546","created_at":"2022-09-04T14:41:01.560356Z","structure_string":"La1 Fe4 Cu3 O12\n1.0\n-3.754026 3.759325 -3.749864\n3.754016 -3.759341 -3.749870\n-3.754010 -3.759324 -3.749881\nLa Fe Cu O\n1 4 3 12\ndirect\n0.000000 0.000000 0.000000 La\n0.000000 0.500000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.500000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.500000 0.500000 0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.000000 0.500000 0.500000 Cu\n0.144313 0.832828 0.688516 O\n0.478657 0.167173 0.688515 O\n0.521343 0.832827 0.311485 O\n0.855687 0.167172 0.311484 O\n0.687906 0.854427 0.833478 O\n0.687906 0.521383 0.166523 O\n0.312094 0.478617 0.833477 O\n0.312094 0.145573 0.166522 O\n0.167247 0.311508 0.521246 O\n0.832755 0.311508 0.855737 O\n0.167245 0.688492 0.144263 O\n0.832753 0.688492 0.478754 O\n","nsites":20,"nelements":4,"elements":["La","Fe","Cu","O"],"chemical_system":"Cu-Fe-La-O","density":5.843527797861923,"density_atomic":0.09448188571813158,"volume":211.6807877826034,"volume_molar":6.373857501072631,"formula_full":"La1 Fe4 Cu3 O12","formula_reduced":"LaFe4(CuO4)3","formula_anonymous":"AB3C4D12","energy":-144.11789677000002,"energy_per_atom":-7.205894838500001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-126.84989677000002,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.35e-05,"is_theoretical":false,"updated_at":"2021-11-28T01:35:11.681000Z","spacegroup":204},{"id":"mp-1176000","created_at":"2022-09-04T14:41:01.581767Z","structure_string":"Li9 Mn2 Co5 O16\n1.0\n-2.970463 0.000000 0.000000\n0.102749 9.987182 0.000000\n-0.009060 -2.081058 -9.793405\nLi Mn Co O\n9 2 5 16\ndirect\n0.998432 0.268117 0.870807 Li\n0.495062 0.741439 0.866513 Li\n0.503762 0.255577 0.630958 Li\n0.993189 0.739634 0.618404 Li\n0.002827 0.261553 0.387426 Li\n0.500984 0.728976 0.373822 Li\n0.497482 0.276326 0.129232 Li\n0.005909 0.727630 0.122583 Li\n0.996650 0.502956 0.249461 Li\n0.990070 0.001444 0.996330 Mn\n0.508580 0.999745 0.252881 Mn\n0.504101 0.497132 0.012997 Co\n0.472495 0.001058 0.738891 Co\n0.002617 0.500181 0.754185 Co\n0.027926 0.997530 0.508798 Co\n0.495432 0.499957 0.492501 Co\n0.492544 0.107781 0.948787 O\n0.007704 0.620569 0.923991 O\n0.991990 0.122125 0.693234 O\n0.494123 0.610489 0.672676 O\n0.523822 0.108751 0.428658 O\n0.967412 0.612579 0.440860 O\n0.005419 0.105342 0.189788 O\n0.499131 0.621710 0.173282 O\n0.507363 0.387077 0.816932 O\n0.978355 0.890051 0.820965 O\n0.031776 0.387678 0.570757 O\n0.509848 0.878056 0.561204 O\n0.499627 0.382201 0.335807 O\n0.006939 0.890250 0.297513 O\n0.998254 0.378423 0.060245 O\n0.490177 0.897664 0.059512 O\n","nsites":32,"nelements":4,"elements":["Li","Mn","Co","O"],"chemical_system":"Co-Li-Mn-O","density":4.132258184045467,"density_atomic":0.11014103469163411,"volume":290.5365842039851,"volume_molar":5.467663143768722,"formula_full":"Li9 Mn2 Co5 O16","formula_reduced":"Li9Mn2Co5O16","formula_anonymous":"A2B5C9D16","energy":-206.59041872,"energy_per_atom":-6.455950585,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-184.07241872,"band_gap":0.0434000000000001,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":14.0007546,"is_theoretical":true,"updated_at":"2021-11-28T01:35:21.010000Z","spacegroup":1},{"id":"mp-1187520","created_at":"2022-09-04T14:41:01.583879Z","structure_string":"Yb1 Sm1 Ag2\n1.0\n0.000000 3.671571 3.671571\n3.671571 0.000000 3.671571\n3.671571 3.671571 0.000000\nYb Sm Ag\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Sm\n0.750000 0.750000 0.750000 Ag\n0.250000 0.250000 0.250000 Ag\n","nsites":4,"nelements":3,"elements":["Yb","Sm","Ag"],"chemical_system":"Ag-Sm-Yb","density":9.044029357847588,"density_atomic":0.04040863710879274,"volume":98.9887382054174,"volume_molar":14.903102878195336,"formula_full":"Yb1 Sm1 Ag2","formula_reduced":"YbSmAg2","formula_anonymous":"ABC2","energy":-13.40021006,"energy_per_atom":-3.350052515,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-13.40021006,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0062948,"is_theoretical":true,"updated_at":"2021-11-28T01:35:12.505000Z","spacegroup":225},{"id":"mp-1520768","created_at":"2022-09-04T14:41:01.587337Z","structure_string":"Li1 Ce1 Ti4 O12\n1.0\n0.000000 -3.753387 -3.778655\n0.000000 -3.753387 3.778655\n-7.745272 0.000000 0.000000\nLi Ce Ti O\n1 1 4 12\ndirect\n0.981151 0.018849 0.000000 Li\n0.524562 0.475438 0.500000 Ce\n0.489007 0.986683 0.229328 Ti\n0.489007 0.986683 0.770672 Ti\n0.013317 0.510993 0.770672 Ti\n0.013317 0.510993 0.229328 Ti\n0.302285 0.300614 0.270373 O\n0.699386 0.697715 0.270373 O\n0.699386 0.697715 0.729627 O\n0.302285 0.300614 0.729627 O\n0.186576 0.813424 0.186535 O\n0.771265 0.228735 0.309699 O\n0.771265 0.228735 0.690301 O\n0.186576 0.813424 0.813465 O\n0.591863 0.024081 0.000000 O\n0.447612 0.932879 0.500000 O\n0.975919 0.408137 0.000000 O\n0.067121 0.552388 0.500000 O\n","nsites":18,"nelements":4,"elements":["Li","Ce","Ti","O"],"chemical_system":"Ce-Li-O-Ti","density":4.009791590473331,"density_atomic":0.08193043266784107,"volume":219.6985834674503,"volume_molar":7.350309968964415,"formula_full":"Li1 Ce1 Ti4 O12","formula_reduced":"LiCeTi4O12","formula_anonymous":"ABC4D12","energy":-153.07171034,"energy_per_atom":-8.503983907777778,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-144.82771034,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.9999997,"is_theoretical":true,"updated_at":"2021-11-28T01:35:08.542000Z","spacegroup":38},{"id":"mp-28650","created_at":"2022-09-04T14:41:01.589838Z","structure_string":"Cs1 Br2 F1\n1.0\n4.392318 0.000000 0.000000\n0.000000 4.392318 0.000000\n0.000000 0.000000 7.372593\nCs Br F\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Cs\n0.500000 0.500000 0.337556 Br\n0.500000 0.500000 0.662444 Br\n0.500000 0.500000 0.000000 F\n","nsites":4,"nelements":3,"elements":["Cs","Br","F"],"chemical_system":"Br-Cs-F","density":3.639105174752634,"density_atomic":0.028122387072314063,"volume":142.23543647679614,"volume_molar":21.414045488082618,"formula_full":"Cs1 Br2 F1","formula_reduced":"CsBr2F","formula_anonymous":"ABC2","energy":-12.03801488,"energy_per_atom":-3.00950372,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-11.57601488,"band_gap":1.7763,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0010647,"is_theoretical":false,"updated_at":"2021-11-28T01:35:11.815000Z","spacegroup":123},{"id":"mp-1274319","created_at":"2022-09-04T14:41:01.590744Z","structure_string":"Li4 V6 O12\n1.0\n1.758946 -4.172979 -2.513649\n4.360358 -0.262933 5.001792\n-4.406177 -4.452725 2.543259\nLi V O\n4 6 12\ndirect\n0.996077 0.675871 0.675567 Li\n0.496252 0.175795 0.175437 Li\n0.998568 0.332513 0.332066 Li\n0.498601 0.832585 0.832103 Li\n0.248713 0.749356 0.248941 V\n0.252493 0.085697 0.583383 V\n0.252342 0.412632 0.914284 V\n0.748704 0.248854 0.749267 V\n0.752552 0.585626 0.083329 V\n0.752203 0.912876 0.414058 V\n0.387690 0.135226 0.855075 O\n0.887832 0.635363 0.354881 O\n0.620770 0.848515 0.134211 O\n0.120927 0.348449 0.634517 O\n0.865434 0.319558 0.037113 O\n0.365512 0.819758 0.536891 O\n0.382338 0.468821 0.184918 O\n0.882280 0.968659 0.684816 O\n0.629089 0.534808 0.814607 O\n0.128932 0.035021 0.314563 O\n0.116319 0.686962 0.969891 O\n0.616373 0.187056 0.470082 O\n","nsites":22,"nelements":3,"elements":["Li","V","O"],"chemical_system":"Li-O-V","density":3.827272559022341,"density_atomic":0.09650906592127938,"volume":227.9578585699398,"volume_molar":6.239974143892498,"formula_full":"Li4 V6 O12","formula_reduced":"Li2V3O6","formula_anonymous":"A2B3C6","energy":-175.71184651,"energy_per_atom":-7.986902114090909,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-157.26784651,"band_gap":0.9769,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.6e-06,"is_theoretical":true,"updated_at":"2021-11-28T01:35:08.226000Z","spacegroup":1},{"id":"mp-769506","created_at":"2022-09-04T14:41:01.591523Z","structure_string":"Na8 Fe4 P4 C4 O28\n1.0\n8.342848 0.000000 0.000000\n-1.809866 8.157970 0.000000\n-3.213184 -3.998716 8.992448\nNa Fe P C O\n8 4 4 4 28\ndirect\n0.460692 0.705879 0.927641 Na\n0.945769 0.199801 0.913230 Na\n0.727584 0.747599 0.731877 Na\n0.999510 0.481763 0.732751 Na\n0.000490 0.518237 0.267249 Na\n0.272416 0.252401 0.268123 Na\n0.539308 0.294121 0.072359 Na\n0.054231 0.800199 0.086770 Na\n0.549421 0.299517 0.656917 Fe\n0.071137 0.821610 0.653800 Fe\n0.928863 0.178390 0.346200 Fe\n0.450579 0.700483 0.343083 Fe\n0.308258 0.557031 0.573723 P\n0.809057 0.060714 0.577994 P\n0.691742 0.442969 0.426277 P\n0.190943 0.939286 0.422006 P\n0.736205 0.481817 0.935985 C\n0.220972 0.975275 0.934591 C\n0.779028 0.024725 0.065409 C\n0.263795 0.518183 0.064015 C\n0.702300 0.937409 0.925581 O\n0.176059 0.441226 0.923462 O\n0.589691 0.340372 0.873562 O\n0.078094 0.827491 0.870253 O\n0.785567 0.537444 0.844238 O\n0.276503 0.024498 0.843196 O\n0.915331 0.978292 0.675692 O\n0.225748 0.663527 0.671273 O\n0.430737 0.490748 0.676089 O\n0.742371 0.183364 0.679497 O\n0.843215 0.598316 0.570274 O\n0.342375 0.086134 0.566325 O\n0.936262 0.183606 0.536936 O\n0.426789 0.678036 0.526166 O\n0.063738 0.816394 0.463064 O\n0.573211 0.321964 0.473834 O\n0.657625 0.913866 0.433675 O\n0.156785 0.401684 0.429726 O\n0.257629 0.816636 0.320503 O\n0.569263 0.509252 0.323911 O\n0.774252 0.336473 0.328727 O\n0.084669 0.021708 0.324308 O\n0.723497 0.975502 0.156804 O\n0.214433 0.462556 0.155762 O\n0.921906 0.172509 0.129747 O\n0.410309 0.659628 0.126438 O\n0.823941 0.558774 0.076538 O\n0.297700 0.062591 0.074419 O\n","nsites":48,"nelements":5,"elements":["Na","Fe","P","C","O"],"chemical_system":"C-Fe-Na-O-P","density":2.787005697245858,"density_atomic":0.07842722835525145,"volume":612.0323388527084,"volume_molar":7.67863519633964,"formula_full":"Na8 Fe4 P4 C4 O28","formula_reduced":"Na2FePCO7","formula_anonymous":"ABCD2E7","energy":-349.11880983,"energy_per_atom":-7.273308538125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-320.85880983,"band_gap":2.1587,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":20.0053006,"is_theoretical":true,"updated_at":"2021-11-28T01:35:09.359000Z","spacegroup":2},{"id":"mp-1225892","created_at":"2022-09-04T14:41:01.593245Z","structure_string":"Cs1 N3\n1.0\n0.000000 4.101117 0.000000\n0.000000 0.000000 5.741748\n4.101117 0.000000 0.000000\nCs N\n1 3\ndirect\n0.500000 0.500000 0.500000 Cs\n0.000000 0.000000 0.000000 N\n0.000000 0.792677 0.000000 N\n0.000000 0.207323 0.000000 N\n","nsites":4,"nelements":2,"elements":["Cs","N"],"chemical_system":"Cs-N","density":3.0078342737685175,"density_atomic":0.041420138313472,"volume":96.57138201054704,"volume_molar":14.539161396381152,"formula_full":"Cs1 N3","formula_reduced":"CsN3","formula_anonymous":"AB3","energy":-27.53220065,"energy_per_atom":-6.8830501625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-26.44920065,"band_gap":3.79,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0005313,"is_theoretical":true,"updated_at":"2021-11-28T01:35:12.214000Z","spacegroup":123},{"id":"mp-1019054","created_at":"2022-09-04T14:41:01.597244Z","structure_string":"Re2 C4\n1.0\n1.435594 -2.486521 0.000000\n1.435594 2.486521 0.000000\n0.000000 0.000000 8.158460\nRe C\n2 4\ndirect\n0.666667 0.333333 0.250000 Re\n0.333333 0.666667 0.750000 Re\n0.000000 0.000000 0.415324 C\n0.000000 0.000000 0.584676 C\n0.000000 0.000000 0.915324 C\n0.000000 0.000000 0.084676 C\n","nsites":6,"nelements":2,"elements":["Re","C"],"chemical_system":"C-Re","density":11.98694542109897,"density_atomic":0.1030123512806668,"volume":58.24544266203999,"volume_molar":5.846037572321898,"formula_full":"Re2 C4","formula_reduced":"ReC2","formula_anonymous":"AB2","energy":-59.19757295,"energy_per_atom":-9.866262158333333,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-59.19757295,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0012081,"is_theoretical":true,"updated_at":"2021-11-28T01:35:10.495000Z","spacegroup":194},{"id":"mp-696078","created_at":"2022-09-04T14:40:59.028940Z","structure_string":"K12 Zr4 H8 S4 O20 F20\n1.0\n16.979859 0.000000 0.000000\n0.000000 6.867246 0.000000\n0.000000 6.659516 8.907905\nK Zr H S O F\n12 4 8 4 20 20\ndirect\n0.167347 0.716939 0.677149 K\n0.332653 0.716939 0.177149 K\n0.832653 0.283061 0.322851 K\n0.667347 0.283061 0.822851 K\n0.384963 0.417153 0.957202 K\n0.115037 0.417153 0.457202 K\n0.615037 0.582847 0.042798 K\n0.884963 0.582847 0.542798 K\n0.382205 0.918930 0.468680 K\n0.117795 0.918930 0.968680 K\n0.617795 0.081070 0.531320 K\n0.882205 0.081070 0.031320 K\n0.692567 0.777163 0.301649 Zr\n0.807433 0.777163 0.801649 Zr\n0.307433 0.222837 0.698351 Zr\n0.192567 0.222837 0.198351 Zr\n0.996830 0.503802 0.799409 H\n0.503170 0.503802 0.299409 H\n0.003170 0.496198 0.200591 H\n0.496830 0.496198 0.700591 H\n0.059653 0.383383 0.923915 H\n0.440347 0.383383 0.423915 H\n0.940347 0.616617 0.076085 H\n0.559653 0.616617 0.576085 H\n0.038991 0.980743 0.326894 S\n0.461009 0.980743 0.826894 S\n0.961009 0.019257 0.673106 S\n0.538991 0.019257 0.173106 S\n0.920439 0.814792 0.677767 O\n0.579561 0.814792 0.177767 O\n0.079561 0.185208 0.322233 O\n0.420439 0.185208 0.822233 O\n0.591951 0.033336 0.278308 O\n0.908049 0.033336 0.778308 O\n0.408049 0.966664 0.721692 O\n0.091951 0.966664 0.221692 O\n0.542350 0.248439 0.020669 O\n0.957650 0.248439 0.520669 O\n0.457650 0.751561 0.979331 O\n0.042350 0.751561 0.479331 O\n0.958190 0.050320 0.270821 O\n0.541810 0.050320 0.770821 O\n0.041810 0.949680 0.729179 O\n0.458190 0.949680 0.229179 O\n0.528282 0.645154 0.638361 O\n0.971718 0.645154 0.138361 O\n0.471718 0.354846 0.361639 O\n0.028282 0.354846 0.861639 O\n0.810286 0.493680 0.782099 F\n0.689714 0.493680 0.282099 F\n0.189714 0.506320 0.217901 F\n0.310286 0.506320 0.717901 F\n0.690192 0.697566 0.804599 F\n0.809808 0.697566 0.304599 F\n0.309808 0.302434 0.195401 F\n0.190192 0.302434 0.695401 F\n0.738871 0.896977 0.417686 F\n0.761129 0.896977 0.917686 F\n0.261129 0.103023 0.582314 F\n0.238871 0.103023 0.082314 F\n0.140991 0.477562 0.990949 F\n0.359009 0.477562 0.490949 F\n0.859009 0.522438 0.009051 F\n0.640991 0.522438 0.509051 F\n0.222762 0.906966 0.400278 F\n0.277238 0.906966 0.900278 F\n0.777238 0.093034 0.599722 F\n0.722762 0.093034 0.099722 F\n","nsites":68,"nelements":6,"elements":["K","Zr","H","S","O","F"],"chemical_system":"F-H-K-O-S-Zr","density":2.670334491190051,"density_atomic":0.06546612739877603,"volume":1038.7050937928452,"volume_molar":9.198865121984582,"formula_full":"K12 Zr4 H8 S4 O20 F20","formula_reduced":"K3ZrH2S(OF)5","formula_anonymous":"ABC2D3E5F5","energy":-414.62394169,"energy_per_atom":-6.097410907205882,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-391.64394169,"band_gap":6.031,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":4.51e-05,"is_theoretical":false,"updated_at":"2021-11-28T01:35:08.991000Z","spacegroup":14}]}