{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=total_magnetization&page=10183","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=total_magnetization&page=10181","results":[{"id":"mp-763434","created_at":"2022-09-04T14:44:56.068832Z","structure_string":"Li10 Mn2 O6 F2\n1.0\n4.750859 0.000000 0.000000\n0.036514 6.703135 0.000000\n0.033401 0.018770 6.712847\nLi Mn O F\n10 2 6 2\ndirect\n0.957035 0.304453 0.247491 Li\n0.033256 0.541452 0.978591 Li\n0.541927 0.507558 0.977186 Li\n0.558505 0.815905 0.202067 Li\n0.017593 0.302819 0.700667 Li\n0.515140 0.229672 0.772522 Li\n0.465327 0.046719 0.472174 Li\n0.956932 0.008058 0.478244 Li\n0.979936 0.721554 0.676863 Li\n0.480283 0.802910 0.748579 Li\n0.980734 0.012032 0.963062 Mn\n0.518598 0.513947 0.482757 Mn\n0.811582 0.292020 0.971186 O\n0.742616 0.257411 0.492571 O\n0.757844 0.755898 0.956643 O\n0.280282 0.523454 0.742757 O\n0.687384 0.793923 0.478147 O\n0.221528 0.026196 0.707103 O\n0.275507 0.517332 0.204809 F\n0.217990 0.026682 0.246579 F\n","nsites":20,"nelements":4,"elements":["Li","Mn","O","F"],"chemical_system":"F-Li-Mn-O","density":2.433458454165108,"density_atomic":0.09355632190227693,"volume":213.77497098368985,"volume_molar":6.436914831143479,"formula_full":"Li10 Mn2 O6 F2","formula_reduced":"Li5MnO3F","formula_anonymous":"ABC3D5","energy":-114.82190155,"energy_per_atom":-5.741095077500001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-106.43990155,"band_gap":2.3168,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":10.0,"is_theoretical":true,"updated_at":"2021-11-28T01:36:42.853000Z","spacegroup":1},{"id":"mp-759948","created_at":"2022-09-04T14:44:58.303860Z","structure_string":"Li4 V2 Cr2 P4 H4 O20\n1.0\n5.168016 0.000000 0.000000\n-2.397499 6.981658 0.000000\n-1.306378 -3.266870 10.056243\nLi V Cr P H O\n4 2 2 4 4 20\ndirect\n0.548210 0.623316 0.800944 Li\n0.951341 0.874519 0.697986 Li\n0.048659 0.125481 0.302014 Li\n0.451790 0.376684 0.199056 Li\n0.000000 0.000000 0.000000 V\n0.500000 0.000000 0.500000 V\n0.000000 0.500000 0.000000 Cr\n0.500000 0.500000 0.500000 Cr\n0.497822 0.052886 0.819704 P\n0.004442 0.448992 0.680270 P\n0.995558 0.551008 0.319730 P\n0.502178 0.947114 0.180296 P\n0.330934 0.312290 0.970708 H\n0.170369 0.192674 0.529761 H\n0.829631 0.807326 0.470239 H\n0.669066 0.687710 0.029292 H\n0.815407 0.698752 0.976537 O\n0.625500 0.279540 0.898205 O\n0.134154 0.488577 0.828262 O\n0.244609 0.946318 0.873162 O\n0.717387 0.950121 0.829981 O\n0.783493 0.550102 0.669533 O\n0.257255 0.554663 0.625836 O\n0.368597 0.015670 0.672073 O\n0.876380 0.221549 0.602295 O\n0.311787 0.202499 0.474475 O\n0.688213 0.797501 0.525525 O\n0.123620 0.778451 0.397705 O\n0.631403 0.984330 0.327927 O\n0.742745 0.445337 0.374164 O\n0.216507 0.449898 0.330467 O\n0.282613 0.049879 0.170019 O\n0.755391 0.053682 0.126838 O\n0.865846 0.511423 0.171738 O\n0.374500 0.720460 0.101795 O\n0.184593 0.301248 0.023463 O\n","nsites":36,"nelements":6,"elements":["Li","V","Cr","P","H","O"],"chemical_system":"Cr-H-Li-O-P-V","density":3.1191136121012635,"density_atomic":0.0992165956274291,"volume":362.84252420013047,"volume_molar":6.0696909845747,"formula_full":"Li4 V2 Cr2 P4 H4 O20","formula_reduced":"Li2VCrP2(HO5)2","formula_anonymous":"ABC2D2E2F10","energy":-268.18596475,"energy_per_atom":-7.449610131944444,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-247.04796475,"band_gap":1.7900999999999998,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":10.0,"is_theoretical":true,"updated_at":"2021-11-28T01:36:47.052000Z","spacegroup":2},{"id":"mp-1222216","created_at":"2022-09-04T14:42:22.424259Z","structure_string":"Mg3 Cr8 Fe1 O16\n1.0\n9.932892 -3.010875 0.000000\n9.932892 3.010875 0.000000\n9.020231 0.000000 5.134507\nMg Cr Fe O\n3 8 1 16\ndirect\n0.187561 0.187561 0.187561 Mg\n0.812432 0.812432 0.812432 Mg\n0.312533 0.312533 0.312533 Mg\n0.999960 0.999960 0.999960 Cr\n0.500062 0.500062 0.500062 Cr\n0.749551 0.250284 0.250284 Cr\n0.249547 0.750398 0.750398 Cr\n0.250284 0.749551 0.250284 Cr\n0.750398 0.249547 0.750398 Cr\n0.250284 0.250284 0.749551 Cr\n0.750398 0.750398 0.249547 Cr\n0.687128 0.687128 0.687128 Fe\n0.119445 0.119445 0.119445 O\n0.619791 0.619791 0.619791 O\n0.343288 0.893445 0.893445 O\n0.847114 0.391790 0.391790 O\n0.893445 0.343288 0.893445 O\n0.391790 0.847114 0.391790 O\n0.893445 0.893445 0.343288 O\n0.391790 0.391790 0.847114 O\n0.380636 0.380636 0.380636 O\n0.880509 0.880509 0.880509 O\n0.152683 0.608474 0.608474 O\n0.652487 0.108248 0.108248 O\n0.608474 0.152683 0.608474 O\n0.108248 0.652487 0.108248 O\n0.608474 0.608474 0.152683 O\n0.108248 0.108248 0.652487 O\n","nsites":28,"nelements":4,"elements":["Mg","Cr","Fe","O"],"chemical_system":"Cr-Fe-Mg-O","density":4.329444281481571,"density_atomic":0.09117186658827929,"volume":307.11228197668134,"volume_molar":6.605262111387093,"formula_full":"Mg3 Cr8 Fe1 O16","formula_reduced":"Mg3Cr8FeO16","formula_anonymous":"AB3C8D16","energy":-240.12251982,"energy_per_atom":-8.575804279285714,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-210.88251982,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":10.0,"is_theoretical":true,"updated_at":"2021-11-28T01:35:40.719000Z","spacegroup":160},{"id":"mp-1047809","created_at":"2022-09-04T14:41:32.989232Z","structure_string":"Zn2 Fe6 P6 O26\n1.0\n6.354408 0.000000 0.000000\n0.000000 7.673291 0.000000\n0.000000 1.850125 9.919650\nZn Fe P O\n2 6 6 26\ndirect\n0.750000 0.374823 0.178842 Zn\n0.250000 0.625177 0.821158 Zn\n0.250000 0.645581 0.206056 Fe\n0.750000 0.354419 0.793944 Fe\n0.250000 0.214993 0.432867 Fe\n0.500000 0.000000 0.000000 Fe\n0.750000 0.785007 0.567133 Fe\n0.000000 0.000000 0.000000 Fe\n0.250000 0.781510 0.498787 P\n0.750000 0.218490 0.501213 P\n0.250000 0.271775 0.760553 P\n0.750000 0.728225 0.239447 P\n0.750000 0.679067 0.889691 P\n0.250000 0.320933 0.110309 P\n0.750000 0.629115 0.747155 O\n0.560033 0.253925 0.402636 O\n0.250000 0.221844 0.622190 O\n0.543950 0.784055 0.902674 O\n0.750000 0.346234 0.601815 O\n0.750000 0.120802 0.902710 O\n0.250000 0.653766 0.398185 O\n0.043950 0.215945 0.097326 O\n0.250000 0.973039 0.417304 O\n0.750000 0.026961 0.582696 O\n0.062819 0.390013 0.787459 O\n0.250000 0.879198 0.097290 O\n0.562819 0.609987 0.212541 O\n0.750000 0.489283 0.976974 O\n0.750000 0.778156 0.377810 O\n0.456050 0.215945 0.097326 O\n0.939967 0.253925 0.402636 O\n0.439967 0.746075 0.597364 O\n0.437181 0.390013 0.787459 O\n0.250000 0.370885 0.252845 O\n0.750000 0.904019 0.130744 O\n0.250000 0.095981 0.869256 O\n0.937181 0.609987 0.212541 O\n0.956050 0.784055 0.902674 O\n0.060033 0.746075 0.597364 O\n0.250000 0.510717 0.023026 O\n","nsites":40,"nelements":4,"elements":["Zn","Fe","P","O"],"chemical_system":"Fe-O-P-Zn","density":3.6656527051497902,"density_atomic":0.08270026047856334,"volume":483.6744137023409,"volume_molar":7.281888503314923,"formula_full":"Zn2 Fe6 P6 O26","formula_reduced":"ZnFe3P3O13","formula_anonymous":"AB3C3D13","energy":-304.03753063000005,"energy_per_atom":-7.600938265750001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-272.63953063,"band_gap":1.9319,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":10.0,"is_theoretical":true,"updated_at":"2021-11-28T01:35:26.295000Z","spacegroup":11},{"id":"mp-775273","created_at":"2022-09-04T14:41:06.293543Z","structure_string":"Cr4 Te2 P6 O24\n1.0\n7.803984 -4.287605 0.000000\n7.803984 4.287605 0.000000\n5.448321 0.000000 7.042835\nCr Te P O\n4 2 6 24\ndirect\n0.147350 0.147350 0.147350 Cr\n0.352650 0.352650 0.352650 Cr\n0.647350 0.647350 0.647350 Cr\n0.852650 0.852650 0.852650 Cr\n0.000000 0.000000 0.000000 Te\n0.500000 0.500000 0.500000 Te\n0.462297 0.750000 0.037703 P\n0.750000 0.037703 0.462297 P\n0.037703 0.462297 0.750000 P\n0.962297 0.537703 0.250000 P\n0.250000 0.962297 0.537703 P\n0.537703 0.250000 0.962297 P\n0.513370 0.290476 0.120599 O\n0.120599 0.513370 0.290476 O\n0.268614 0.922185 0.063550 O\n0.290476 0.120599 0.513370 O\n0.436450 0.577815 0.231386 O\n0.620599 0.790476 0.013370 O\n0.922185 0.063550 0.268614 O\n0.577815 0.231386 0.436450 O\n0.231386 0.436450 0.577815 O\n0.986630 0.379401 0.209524 O\n0.936450 0.731386 0.077815 O\n0.209524 0.986630 0.379401 O\n0.790476 0.013370 0.620599 O\n0.063550 0.268614 0.922185 O\n0.013370 0.620599 0.790476 O\n0.768614 0.563550 0.422185 O\n0.422185 0.768614 0.563550 O\n0.077815 0.936450 0.731386 O\n0.379401 0.209524 0.986630 O\n0.563550 0.422185 0.768614 O\n0.709524 0.879401 0.486630 O\n0.731386 0.077815 0.936450 O\n0.879401 0.486630 0.709524 O\n0.486630 0.709524 0.879401 O\n","nsites":36,"nelements":4,"elements":["Cr","Te","P","O"],"chemical_system":"Cr-O-P-Te","density":3.639536305527331,"density_atomic":0.07638249710103721,"volume":471.31216399458543,"volume_molar":7.884189426321105,"formula_full":"Cr4 Te2 P6 O24","formula_reduced":"Cr2Te(PO4)3","formula_anonymous":"AB2C3D12","energy":-280.38885766,"energy_per_atom":-7.788579379444444,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-255.90485766,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":10.0,"is_theoretical":true,"updated_at":"2021-11-28T01:35:17.272000Z","spacegroup":167},{"id":"mp-557942","created_at":"2022-09-04T14:41:18.398120Z","structure_string":"Sr2 Fe6 P6 O26\n1.0\n6.434141 0.000000 0.000000\n0.000000 7.702451 0.000000\n0.000000 1.739311 10.330438\nSr Fe P O\n2 6 6 26\ndirect\n0.250000 0.336299 0.701220 Sr\n0.750000 0.663701 0.298780 Sr\n0.250000 0.789357 0.058234 Fe\n0.000000 0.000000 0.500000 Fe\n0.750000 0.210643 0.941766 Fe\n0.250000 0.350502 0.301928 Fe\n0.750000 0.649498 0.698072 Fe\n0.500000 0.000000 0.500000 Fe\n0.250000 0.216252 0.019088 P\n0.750000 0.783748 0.980912 P\n0.750000 0.312350 0.616496 P\n0.750000 0.253163 0.262969 P\n0.250000 0.746837 0.737031 P\n0.250000 0.687650 0.383504 P\n0.250000 0.800393 0.871439 O\n0.750000 0.079322 0.367201 O\n0.059253 0.249558 0.925870 O\n0.938399 0.367419 0.287683 O\n0.559253 0.750442 0.074130 O\n0.447775 0.790856 0.408006 O\n0.561601 0.367419 0.287683 O\n0.250000 0.122352 0.410379 O\n0.940747 0.750442 0.074130 O\n0.250000 0.024164 0.092434 O\n0.947775 0.209144 0.591994 O\n0.061601 0.632581 0.712317 O\n0.052225 0.790856 0.408006 O\n0.750000 0.348830 0.759611 O\n0.250000 0.345001 0.114995 O\n0.552225 0.209144 0.591994 O\n0.438399 0.632581 0.712317 O\n0.750000 0.503557 0.541984 O\n0.750000 0.199607 0.128561 O\n0.250000 0.920678 0.632799 O\n0.250000 0.496443 0.458016 O\n0.750000 0.877648 0.589621 O\n0.440747 0.249558 0.925870 O\n0.750000 0.975836 0.907566 O\n0.750000 0.654999 0.885005 O\n0.250000 0.651170 0.240389 O\n","nsites":40,"nelements":4,"elements":["Sr","Fe","P","O"],"chemical_system":"Fe-O-P-Sr","density":3.607190865204056,"density_atomic":0.07813070401530368,"volume":511.9626208944064,"volume_molar":7.707777417211581,"formula_full":"Sr2 Fe6 P6 O26","formula_reduced":"SrFe3P3O13","formula_anonymous":"AB3C3D13","energy":-316.00078579,"energy_per_atom":-7.90001964475,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-284.60278579,"band_gap":2.0126,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":10.0,"is_theoretical":false,"updated_at":"2021-11-28T01:35:15.683000Z","spacegroup":11},{"id":"mp-22398","created_at":"2022-09-04T14:44:19.422100Z","structure_string":"Fe2 F6\n1.0\n4.775581 -2.648558 0.000000\n4.775581 2.648558 0.000000\n3.306679 0.000000 4.345906\nFe F\n2 6\ndirect\n0.500000 0.500000 0.500000 Fe\n0.000000 0.000000 0.000000 Fe\n0.250000 0.662383 0.837617 F\n0.837617 0.250000 0.662383 F\n0.662383 0.837617 0.250000 F\n0.750000 0.337617 0.162383 F\n0.162383 0.750000 0.337617 F\n0.337617 0.162383 0.750000 F\n","nsites":8,"nelements":2,"elements":["Fe","F"],"chemical_system":"F-Fe","density":3.4087641178073995,"density_atomic":0.0727685899022557,"volume":109.93754325521174,"volume_molar":8.27574200364342,"formula_full":"Fe2 F6","formula_reduced":"FeF3","formula_anonymous":"AB3","energy":-49.46267745,"energy_per_atom":-6.18283468125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-42.17867745,"band_gap":3.1061,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":10.0,"is_theoretical":false,"updated_at":"2021-11-28T01:36:35.469000Z","spacegroup":167},{"id":"mp-754446","created_at":"2022-09-04T14:44:25.984212Z","structure_string":"Li4 Mn2 F8\n1.0\n0.000000 4.307101 4.307101\n4.307101 0.000000 4.307101\n4.307101 4.307101 0.000000\nLi Mn F\n4 2 8\ndirect\n0.625000 0.625000 0.125000 Li\n0.625000 0.625000 0.625000 Li\n0.625000 0.125000 0.625000 Li\n0.125000 0.625000 0.625000 Li\n0.250000 0.250000 0.250000 Mn\n0.000000 0.000000 0.000000 Mn\n0.864553 0.864553 0.406340 F\n0.864553 0.406340 0.864553 F\n0.864553 0.864553 0.864553 F\n0.406340 0.864553 0.864553 F\n0.843660 0.385447 0.385447 F\n0.385447 0.385447 0.385447 F\n0.385447 0.843660 0.385447 F\n0.385447 0.385447 0.843660 F\n","nsites":14,"nelements":3,"elements":["Li","Mn","F"],"chemical_system":"F-Li-Mn","density":3.009563097555036,"density_atomic":0.08760781971000609,"volume":159.80308660051034,"volume_molar":6.873976295648165,"formula_full":"Li4 Mn2 F8","formula_reduced":"Li2MnF4","formula_anonymous":"AB2C4","energy":-83.63450264,"energy_per_atom":-5.973893045714285,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-76.60250264,"band_gap":3.9058,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":10.0,"is_theoretical":true,"updated_at":"2021-11-28T01:36:33.799000Z","spacegroup":227},{"id":"mp-1520623","created_at":"2022-09-04T14:39:15.332493Z","structure_string":"K1 Eu1 Mn1 Bi1 O6\n1.0\n0.000000 -4.087471 -4.087471\n4.087471 -0.000000 -4.087471\n4.087471 -4.087471 0.000000\nK Eu Mn Bi O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 Eu\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Bi\n0.739258 0.260742 0.260742 O\n0.260742 0.739258 0.739258 O\n0.739258 0.260742 0.739258 O\n0.260742 0.739258 0.260742 O\n0.739258 0.739258 0.260742 O\n0.260742 0.260742 0.739258 O\n","nsites":10,"nelements":5,"elements":["K","Eu","Mn","Bi","O"],"chemical_system":"Bi-Eu-K-Mn-O","density":6.698670761985239,"density_atomic":0.07321599201272193,"volume":136.58218273218796,"volume_molar":8.225171297212773,"formula_full":"K1 Eu1 Mn1 Bi1 O6","formula_reduced":"KEuMnBiO6","formula_anonymous":"ABCDE6","energy":-73.56772213,"energy_per_atom":-7.356772213000001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-67.77772213,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":10.0,"is_theoretical":true,"updated_at":"2021-11-28T01:34:26.373000Z","spacegroup":216},{"id":"mp-775162","created_at":"2022-09-04T14:48:18.493159Z","structure_string":"V3 Co3 Te2 O16\n1.0\n5.869463 0.000000 0.000000\n-2.853370 5.165993 0.000000\n-0.038456 -0.294035 10.100912\nV Co Te O\n3 3 2 16\ndirect\n0.333831 0.180312 0.237009 V\n0.208143 0.339442 0.698617 V\n0.164146 0.799338 0.719342 V\n0.823435 0.177721 0.226321 Co\n0.832458 0.659378 0.222177 Co\n0.659229 0.836450 0.685421 Co\n0.682582 0.341223 0.487802 Te\n0.348579 0.677629 0.024557 Te\n0.835153 0.174852 0.585186 O\n0.953884 0.474170 0.354135 O\n0.632025 0.301054 0.128815 O\n0.013502 0.023635 0.305065 O\n0.007849 0.010724 0.770565 O\n0.835961 0.662877 0.586243 O\n0.507557 0.045048 0.352255 O\n0.497553 0.460649 0.356779 O\n0.680347 0.838301 0.109322 O\n0.346340 0.181279 0.583653 O\n0.464512 0.484478 0.804704 O\n0.450629 0.963051 0.809652 O\n0.307309 0.649397 0.601864 O\n0.197597 0.361447 0.129222 O\n0.024019 0.514398 0.806069 O\n0.193362 0.842950 0.130944 O\n","nsites":24,"nelements":4,"elements":["V","Co","Te","O"],"chemical_system":"Co-O-Te-V","density":4.558652755967609,"density_atomic":0.07836072971141354,"volume":306.2758614983177,"volume_molar":7.685151455554724,"formula_full":"V3 Co3 Te2 O16","formula_reduced":"V3Co3(TeO8)2","formula_anonymous":"A2B3C3D16","energy":-174.79055317,"energy_per_atom":-7.282939715416667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-153.78455317,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":10.0,"is_theoretical":true,"updated_at":"2021-11-28T01:38:41.274000Z","spacegroup":1},{"id":"mp-774430","created_at":"2022-09-04T14:48:15.568944Z","structure_string":"Li4 Mn2 F8\n1.0\n1.488183 -4.828663 0.000000\n1.488183 4.828663 0.000000\n0.000000 0.000000 9.901723\nLi Mn F\n4 2 8\ndirect\n0.625732 0.374268 0.438901 Li\n0.625732 0.374268 0.061099 Li\n0.374268 0.625732 0.561099 Li\n0.374268 0.625732 0.938901 Li\n0.881967 0.118033 0.250000 Mn\n0.118033 0.881967 0.750000 Mn\n0.000000 0.000000 0.000000 F\n0.000000 0.000000 0.500000 F\n0.541627 0.458373 0.250000 F\n0.721037 0.278963 0.618054 F\n0.721037 0.278963 0.881946 F\n0.458373 0.541627 0.750000 F\n0.278963 0.721037 0.118054 F\n0.278963 0.721037 0.381946 F\n","nsites":14,"nelements":3,"elements":["Li","Mn","F"],"chemical_system":"F-Li-Mn","density":3.3795946390324043,"density_atomic":0.09837936877608182,"volume":142.30625967793063,"volume_molar":6.121345191497219,"formula_full":"Li4 Mn2 F8","formula_reduced":"Li2MnF4","formula_anonymous":"AB2C4","energy":-83.70533179,"energy_per_atom":-5.978952270714286,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-76.67333179,"band_gap":4.3323,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":10.0,"is_theoretical":true,"updated_at":"2021-11-28T01:38:45.321000Z","spacegroup":63},{"id":"mp-1357073","created_at":"2022-09-04T14:47:42.711618Z","structure_string":"Ba4 Mg2 V4 Cu2 F28\n1.0\n2.669328 7.031839 0.000000\n-2.669328 7.031839 0.000000\n0.000000 0.566509 14.744506\nBa Mg V Cu F\n4 2 4 2 28\ndirect\n0.740018 0.891350 0.124353 Ba\n0.891350 0.740018 0.624353 Ba\n0.259982 0.108650 0.875647 Ba\n0.108650 0.259982 0.375647 Ba\n0.433004 0.566996 0.250000 Mg\n0.566996 0.433004 0.750000 Mg\n0.856253 0.901312 0.373795 V\n0.143747 0.098688 0.626205 V\n0.901312 0.856253 0.873795 V\n0.098688 0.143747 0.126205 V\n0.500000 0.500000 0.500000 Cu\n0.500000 0.500000 0.000000 Cu\n0.911622 0.103086 0.837769 F\n0.596420 0.124849 0.957319 F\n0.403580 0.875151 0.042681 F\n0.148055 0.354061 0.098840 F\n0.505502 0.399714 0.127059 F\n0.600286 0.494498 0.372941 F\n0.124849 0.596420 0.457319 F\n0.896914 0.088378 0.662231 F\n0.038809 0.634188 0.274724 F\n0.851945 0.645939 0.901160 F\n0.577574 0.192335 0.290389 F\n0.645939 0.851945 0.401160 F\n0.192335 0.577574 0.790389 F\n0.422426 0.807665 0.709611 F\n0.399714 0.505502 0.627059 F\n0.961191 0.365812 0.725276 F\n0.295895 0.870548 0.516938 F\n0.088378 0.896914 0.162231 F\n0.704105 0.129452 0.483062 F\n0.870548 0.295895 0.016938 F\n0.875151 0.403580 0.542681 F\n0.807665 0.422426 0.209611 F\n0.634188 0.038809 0.774724 F\n0.129452 0.704105 0.983062 F\n0.494498 0.600286 0.872941 F\n0.103086 0.911622 0.337769 F\n0.365812 0.961191 0.225276 F\n0.354061 0.148055 0.598840 F\n","nsites":40,"nelements":5,"elements":["Ba","Mg","V","Cu","F"],"chemical_system":"Ba-Cu-F-Mg-V","density":4.382161175004879,"density_atomic":0.07226514999958059,"volume":553.5171517700047,"volume_molar":8.333395502583128,"formula_full":"Ba4 Mg2 V4 Cu2 F28","formula_reduced":"Ba2MgV2CuF14","formula_anonymous":"ABC2D2E14","energy":-243.73202966,"energy_per_atom":-6.0933007415,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-223.99602966,"band_gap":0.2219,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":10.0,"is_theoretical":true,"updated_at":"2021-11-28T01:38:23.599000Z","spacegroup":15}]}