{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-is_stable&page=10233","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-is_stable&page=10231","results":[{"id":"mp-706654","created_at":"2022-09-04T14:46:27.329562Z","structure_string":"H16 S48 N16\n1.0\n8.537202 0.000000 0.000000\n0.000000 13.139007 0.000000\n0.000000 0.000000 14.622239\nH S N\n16 48 16\ndirect\n0.629947 0.062570 0.169681 H\n0.129947 0.437430 0.830319 H\n0.370053 0.562570 0.330319 H\n0.870053 0.937430 0.669681 H\n0.370053 0.937430 0.830319 H\n0.870053 0.562570 0.169681 H\n0.629947 0.437430 0.669681 H\n0.129947 0.062570 0.330319 H\n0.792797 0.230493 0.007104 H\n0.292797 0.269507 0.992896 H\n0.207203 0.730493 0.492896 H\n0.707203 0.769507 0.507104 H\n0.207203 0.769507 0.992896 H\n0.707203 0.730493 0.007104 H\n0.792797 0.269507 0.507104 H\n0.292797 0.230493 0.492896 H\n0.591256 0.349984 0.990744 S\n0.091256 0.150016 0.009256 S\n0.408744 0.849984 0.509256 S\n0.908744 0.650016 0.490744 S\n0.408744 0.650016 0.009256 S\n0.908744 0.849984 0.990744 S\n0.591256 0.150016 0.490744 S\n0.091256 0.349984 0.509256 S\n0.395815 0.145368 0.202595 S\n0.895815 0.354632 0.797405 S\n0.604185 0.645368 0.297405 S\n0.104185 0.854632 0.702595 S\n0.604185 0.854632 0.797405 S\n0.104185 0.645368 0.202595 S\n0.395815 0.354632 0.702595 S\n0.895815 0.145368 0.297405 S\n0.595584 0.433841 0.110551 S\n0.095584 0.066159 0.889449 S\n0.404416 0.933841 0.389449 S\n0.904416 0.566159 0.610551 S\n0.404416 0.566159 0.889449 S\n0.904416 0.933841 0.110551 S\n0.595584 0.066159 0.610551 S\n0.095584 0.433841 0.389449 S\n0.400864 0.399409 0.189356 S\n0.900864 0.100591 0.810644 S\n0.599136 0.899409 0.310644 S\n0.099136 0.600591 0.689356 S\n0.599136 0.600591 0.810644 S\n0.099136 0.899409 0.189356 S\n0.400864 0.100591 0.689356 S\n0.900864 0.399409 0.310644 S\n0.460361 0.275836 0.270807 S\n0.960361 0.224164 0.729193 S\n0.539639 0.775836 0.229193 S\n0.039639 0.724164 0.770807 S\n0.539639 0.724164 0.729193 S\n0.039639 0.775836 0.270807 S\n0.460361 0.224164 0.770807 S\n0.960361 0.275836 0.229193 S\n0.568223 0.128006 0.024700 S\n0.068223 0.371994 0.975300 S\n0.431777 0.628006 0.475300 S\n0.931777 0.871994 0.524700 S\n0.431777 0.871994 0.975300 S\n0.931777 0.628006 0.024700 S\n0.568223 0.371994 0.524700 S\n0.068223 0.128006 0.475300 S\n0.544711 0.103653 0.137048 N\n0.044711 0.396347 0.862952 N\n0.455289 0.603653 0.362952 N\n0.955289 0.896347 0.637048 N\n0.455289 0.896347 0.862952 N\n0.955289 0.603653 0.137048 N\n0.544711 0.396347 0.637048 N\n0.044711 0.103653 0.362952 N\n0.672686 0.234822 0.008084 N\n0.172686 0.265178 0.991916 N\n0.327314 0.734822 0.491916 N\n0.827314 0.765178 0.508084 N\n0.327314 0.765178 0.991916 N\n0.827314 0.734822 0.008084 N\n0.672686 0.265178 0.508084 N\n0.172686 0.234822 0.491916 N\n","nsites":80,"nelements":3,"elements":["H","S","N"],"chemical_system":"H-N-S","density":1.8014388949791151,"density_atomic":0.048775081907702,"volume":1640.181766406574,"volume_molar":12.346756836607286,"formula_full":"H16 S48 N16","formula_reduced":"HS3N","formula_anonymous":"ABC3","energy":-388.49423011,"energy_per_atom":-4.856177876375,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-379.85423011,"band_gap":2.8815,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":false,"updated_at":"2021-11-28T01:37:35.176000Z","spacegroup":61},{"id":"mp-1217632","created_at":"2022-09-04T14:46:27.331684Z","structure_string":"U16 Pb6\n1.0\n0.000000 0.000000 6.162026\n9.147494 0.000000 0.000000\n0.000000 9.641425 0.000000\nU Pb\n16 6\ndirect\n0.750000 0.560470 0.425345 U\n0.750000 0.078143 0.097393 U\n0.250000 0.421857 0.597393 U\n0.250000 0.939530 0.925345 U\n0.984974 0.734247 0.150448 U\n0.498182 0.332494 0.403934 U\n0.501818 0.167506 0.903934 U\n0.015026 0.765753 0.650448 U\n0.998182 0.167506 0.903934 U\n0.484974 0.765753 0.650448 U\n0.515026 0.734247 0.150448 U\n0.001818 0.332494 0.403934 U\n0.250000 0.654176 0.350763 U\n0.250000 0.301914 0.082138 U\n0.750000 0.198086 0.582138 U\n0.750000 0.845824 0.850763 U\n0.250000 0.017538 0.265253 Pb\n0.750000 0.482462 0.765253 Pb\n0.750000 0.422806 0.109671 Pb\n0.750000 0.919522 0.393672 Pb\n0.250000 0.580478 0.893672 Pb\n0.250000 0.077194 0.609671 Pb\n","nsites":22,"nelements":2,"elements":["U","Pb"],"chemical_system":"Pb-U","density":15.43535219460833,"density_atomic":0.040481425184920525,"volume":543.4591272294207,"volume_molar":14.876306188556,"formula_full":"U16 Pb6","formula_reduced":"U8Pb3","formula_anonymous":"A3B8","energy":-195.43901083,"energy_per_atom":-8.883591401363637,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-195.43901083,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.2500859,"is_theoretical":true,"updated_at":"2021-11-28T01:37:40.702000Z","spacegroup":31},{"id":"mp-31247","created_at":"2022-09-04T14:46:27.334650Z","structure_string":"Eu4 Te8 O22\n1.0\n2.650050 6.327380 0.000000\n-2.650050 6.327380 0.000000\n0.000000 4.114878 16.130875\nEu Te O\n4 8 22\ndirect\n0.128649 0.631295 0.538807 Eu\n0.368705 0.871351 0.961193 Eu\n0.871351 0.368705 0.461193 Eu\n0.631295 0.128649 0.038807 Eu\n0.599575 0.160539 0.699128 Te\n0.839461 0.400425 0.800872 Te\n0.400425 0.839461 0.300872 Te\n0.160539 0.599575 0.199128 Te\n0.151061 0.586065 0.875261 Te\n0.413935 0.848939 0.624739 Te\n0.848939 0.413935 0.124739 Te\n0.586065 0.151061 0.375261 Te\n0.850259 0.149741 0.750000 O\n0.149741 0.850259 0.250000 O\n0.196121 0.102104 0.830279 O\n0.897896 0.803879 0.669721 O\n0.803879 0.897896 0.169721 O\n0.102104 0.196121 0.330279 O\n0.601819 0.445840 0.897578 O\n0.554160 0.398181 0.602422 O\n0.398181 0.554160 0.102422 O\n0.445840 0.601819 0.397578 O\n0.037971 0.820601 0.951873 O\n0.179399 0.962029 0.548127 O\n0.677479 0.814395 0.371759 O\n0.185605 0.322521 0.128241 O\n0.322521 0.185605 0.628241 O\n0.814395 0.677479 0.871759 O\n0.256303 0.327847 0.447239 O\n0.672153 0.743697 0.052761 O\n0.743697 0.672153 0.552761 O\n0.327847 0.256303 0.947239 O\n0.820601 0.037971 0.451873 O\n0.962029 0.179399 0.048127 O\n","nsites":34,"nelements":3,"elements":["Eu","Te","O"],"chemical_system":"Eu-O-Te","density":6.079800797656007,"density_atomic":0.06285111838957116,"volume":540.9609386623356,"volume_molar":9.581596818489151,"formula_full":"Eu4 Te8 O22","formula_reduced":"Eu2Te4O11","formula_anonymous":"A2B4C11","energy":-244.70844487,"energy_per_atom":-7.197307202058823,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-229.59444487,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":24.0000593,"is_theoretical":false,"updated_at":"2021-11-28T01:37:42.880000Z","spacegroup":15},{"id":"mp-774679","created_at":"2022-09-04T14:46:27.346048Z","structure_string":"Ti1 Ni3 P4 O16\n1.0\n5.888798 0.000000 0.000000\n0.000000 4.874011 0.000000\n0.000000 0.199345 9.956604\nTi Ni P O\n1 3 4 16\ndirect\n0.500000 0.968324 0.727802 Ti\n0.000000 0.051142 0.280824 Ni\n0.000000 0.462224 0.770210 Ni\n0.500000 0.549602 0.223233 Ni\n0.500000 0.088942 0.401694 P\n0.500000 0.389428 0.905727 P\n0.000000 0.597176 0.098840 P\n0.000000 0.925672 0.594750 P\n0.500000 0.144904 0.556285 O\n0.293913 0.238420 0.334591 O\n0.706087 0.238420 0.334591 O\n0.000000 0.233741 0.607818 O\n0.000000 0.282428 0.117919 O\n0.300141 0.242820 0.828565 O\n0.699859 0.242820 0.828565 O\n0.500000 0.334690 0.053695 O\n0.000000 0.651145 0.947432 O\n0.794727 0.738521 0.168454 O\n0.205273 0.738521 0.168454 O\n0.500000 0.699420 0.869212 O\n0.500000 0.779540 0.385565 O\n0.793242 0.786453 0.673389 O\n0.206758 0.786453 0.673389 O\n0.000000 0.829195 0.448993 O\n","nsites":24,"nelements":4,"elements":["Ti","Ni","P","O"],"chemical_system":"Ni-O-P-Ti","density":3.5086600464919706,"density_atomic":0.08398212222376455,"volume":285.77510742171603,"volume_molar":7.170741344157061,"formula_full":"Ti1 Ni3 P4 O16","formula_reduced":"TiNi3(PO4)4","formula_anonymous":"AB3C4D16","energy":-181.12831312,"energy_per_atom":-7.547013046666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-162.51331312,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":5.5835651,"is_theoretical":true,"updated_at":"2021-11-28T01:37:38.180000Z","spacegroup":6},{"id":"mp-1520962","created_at":"2022-09-04T14:46:27.221341Z","structure_string":"Ba4 Y4 Nb4 Sn4 O24\n1.0\n8.436287 0.000000 0.000000\n0.000000 8.490378 0.000000\n0.000000 0.000000 8.442101\nBa Y Nb Sn O\n4 4 4 4 24\ndirect\n-0.000000 -0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n0.244704 0.249610 0.249293 Y\n0.755296 0.750390 0.249293 Y\n0.755296 0.249610 0.750707 Y\n0.244704 0.750390 0.750707 Y\n0.751576 0.751006 0.747762 Nb\n0.248424 0.248994 0.747762 Nb\n0.248424 0.751006 0.252238 Nb\n0.751576 0.248994 0.252238 Nb\n-0.000000 0.500000 0.500000 Sn\n0.500000 0.000000 0.000000 Sn\n-0.000000 0.500000 0.000000 Sn\n-0.000000 -0.000000 0.500000 Sn\n0.984950 0.202233 0.284320 O\n0.015050 0.797767 0.284320 O\n0.015050 0.202233 0.715681 O\n0.984950 0.797767 0.715681 O\n0.283994 0.985233 0.208607 O\n0.283994 0.014767 0.791393 O\n0.716006 0.014767 0.208607 O\n0.716006 0.985233 0.791393 O\n0.209456 0.288075 0.984225 O\n0.790544 0.288075 0.015775 O\n0.209456 0.711925 0.015775 O\n0.790544 0.711925 0.984225 O\n0.514130 0.278944 0.230436 O\n0.485870 0.721056 0.230436 O\n0.485870 0.278944 0.769564 O\n0.514130 0.721056 0.769564 O\n0.216035 0.514141 0.286438 O\n0.216035 0.485859 0.713562 O\n0.783965 0.485859 0.286438 O\n0.783965 0.514141 0.713562 O\n0.277209 0.225678 0.513311 O\n0.722791 0.225678 0.486689 O\n0.277209 0.774322 0.486689 O\n0.722791 0.774322 0.513311 O\n","nsites":40,"nelements":5,"elements":["Ba","Y","Nb","Sn","O"],"chemical_system":"Ba-Nb-O-Sn-Y","density":5.864025704283181,"density_atomic":0.06615018694384593,"volume":604.6846100972549,"volume_molar":9.103739593528466,"formula_full":"Ba4 Y4 Nb4 Sn4 O24","formula_reduced":"BaYNbSnO6","formula_anonymous":"ABCDE6","energy":-328.79577839,"energy_per_atom":-8.21989445975,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-312.30777839,"band_gap":2.0256000000000003,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:37:39.944000Z","spacegroup":16},{"id":"mp-1044445","created_at":"2022-09-04T14:46:27.246303Z","structure_string":"Ca4 Co4 Bi4 O20\n1.0\n10.705751 0.000000 0.000000\n0.000000 5.875177 0.000000\n0.000000 2.526982 8.035905\nCa Co Bi O\n4 4 4 20\ndirect\n0.094008 0.538706 0.809901 Ca\n0.905992 0.461294 0.190099 Ca\n0.594008 0.461294 0.690099 Ca\n0.405992 0.538706 0.309901 Ca\n0.372495 0.137816 0.046876 Co\n0.627505 0.862184 0.953124 Co\n0.872495 0.862184 0.453124 Co\n0.127505 0.137816 0.546876 Co\n0.899075 0.007516 0.846130 Bi\n0.100925 0.992484 0.153870 Bi\n0.600925 0.007516 0.346130 Bi\n0.399075 0.992484 0.653870 Bi\n0.933747 0.822998 0.661892 O\n0.028689 0.256402 0.683049 O\n0.786454 0.148041 0.337518 O\n0.457451 0.776289 0.491497 O\n0.718003 0.706692 0.482887 O\n0.781997 0.706692 0.982887 O\n0.471311 0.256402 0.183049 O\n0.528689 0.743598 0.816951 O\n0.542549 0.223711 0.508503 O\n0.433747 0.177002 0.838108 O\n0.281997 0.293308 0.517113 O\n0.066253 0.177002 0.338108 O\n0.566253 0.822998 0.161892 O\n0.218003 0.293308 0.017113 O\n0.957451 0.223711 0.008503 O\n0.042549 0.776289 0.991497 O\n0.213546 0.851959 0.662482 O\n0.971311 0.743598 0.316951 O\n0.286454 0.851959 0.162482 O\n0.713546 0.148041 0.837518 O\n","nsites":32,"nelements":4,"elements":["Ca","Co","Bi","O"],"chemical_system":"Bi-Ca-Co-O","density":5.098649539645565,"density_atomic":0.06331069648944852,"volume":505.44381556966727,"volume_molar":9.51204313635005,"formula_full":"Ca4 Co4 Bi4 O20","formula_reduced":"CaCoBiO5","formula_anonymous":"ABCD5","energy":-208.99776604,"energy_per_atom":-6.53118018875,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-188.70576604,"band_gap":0.6493,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":16.0007424,"is_theoretical":true,"updated_at":"2021-11-28T01:37:36.451000Z","spacegroup":14},{"id":"mp-1186229","created_at":"2022-09-04T14:46:27.256953Z","structure_string":"Nb2 Ru6\n1.0\n2.802034 -4.853265 0.000000\n2.802034 4.853265 0.000000\n0.000000 0.000000 4.390370\nNb Ru\n2 6\ndirect\n0.666667 0.333333 0.250000 Nb\n0.333333 0.666667 0.750000 Nb\n0.834020 0.165980 0.750000 Ru\n0.331961 0.165980 0.750000 Ru\n0.834020 0.668039 0.750000 Ru\n0.165980 0.834020 0.250000 Ru\n0.668039 0.834020 0.250000 Ru\n0.165980 0.331961 0.250000 Ru\n","nsites":8,"nelements":2,"elements":["Nb","Ru"],"chemical_system":"Nb-Ru","density":11.017000537835793,"density_atomic":0.06699639940642757,"volume":119.40940216008815,"volume_molar":8.988752848443736,"formula_full":"Nb2 Ru6","formula_reduced":"NbRu3","formula_anonymous":"AB3","energy":-76.81743424,"energy_per_atom":-9.60217928,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-76.81743424,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0132586,"is_theoretical":true,"updated_at":"2021-11-28T01:37:33.617000Z","spacegroup":194},{"id":"mp-1210192","created_at":"2022-09-04T14:46:27.265559Z","structure_string":"Na4 Fe4 Br16\n1.0\n7.681931 0.000000 0.000000\n0.000000 7.759738 0.000000\n0.000000 0.000000 14.286872\nNa Fe Br\n4 4 16\ndirect\n0.550785 0.750000 0.848743 Na\n0.449215 0.250000 0.151257 Na\n0.050785 0.250000 0.651257 Na\n0.949215 0.750000 0.348743 Na\n0.797224 0.750000 0.602456 Fe\n0.202776 0.250000 0.397544 Fe\n0.297224 0.250000 0.897544 Fe\n0.702776 0.750000 0.102456 Fe\n0.091360 0.750000 0.555750 Br\n0.908640 0.250000 0.444250 Br\n0.591360 0.250000 0.944250 Br\n0.408640 0.750000 0.055750 Br\n0.736217 0.504978 0.696375 Br\n0.263783 0.495022 0.303625 Br\n0.236217 0.495022 0.803625 Br\n0.263783 0.004978 0.303625 Br\n0.763783 0.504978 0.196375 Br\n0.736217 0.995022 0.696375 Br\n0.763783 0.995022 0.196375 Br\n0.236217 0.004978 0.803625 Br\n0.874640 0.750000 0.966842 Br\n0.125360 0.250000 0.033158 Br\n0.374640 0.250000 0.533158 Br\n0.625360 0.750000 0.466842 Br\n","nsites":24,"nelements":3,"elements":["Na","Fe","Br"],"chemical_system":"Br-Fe-Na","density":3.1076288507246304,"density_atomic":0.028181014797665466,"volume":851.6371809998899,"volume_molar":21.36949575179556,"formula_full":"Na4 Fe4 Br16","formula_reduced":"NaFeBr4","formula_anonymous":"ABC4","energy":-94.83351935,"energy_per_atom":-3.9513966395833333,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-86.28951935,"band_gap":1.0155,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":19.9385169,"is_theoretical":true,"updated_at":"2021-11-28T01:37:43.008000Z","spacegroup":62},{"id":"mp-1174183","created_at":"2022-09-04T14:46:27.285253Z","structure_string":"Li4 Mn3 Co1 O8\n1.0\n3.087781 0.000000 0.000000\n-1.134157 5.009353 0.000000\n-0.699432 -2.171486 9.890390\nLi Mn Co O\n4 3 1 8\ndirect\n0.736203 0.493074 0.124003 Li\n0.250847 0.500912 0.374626 Li\n0.749153 0.499088 0.625374 Li\n0.263797 0.506926 0.875997 Li\n0.512054 0.001076 0.248144 Mn\n0.000000 0.000000 0.500000 Mn\n0.487946 0.998924 0.751856 Mn\n0.000000 0.000000 0.000000 Co\n0.413811 0.775271 0.065911 O\n0.859945 0.768037 0.317734 O\n0.351277 0.767607 0.569136 O\n0.844129 0.766604 0.821149 O\n0.155871 0.233396 0.178851 O\n0.648723 0.232393 0.430864 O\n0.140055 0.231963 0.682266 O\n0.586189 0.224729 0.934089 O\n","nsites":16,"nelements":4,"elements":["Li","Mn","Co","O"],"chemical_system":"Co-Li-Mn-O","density":4.119332099626681,"density_atomic":0.1045871764038887,"volume":152.9824262413599,"volume_molar":5.758010653948669,"formula_full":"Li4 Mn3 Co1 O8","formula_reduced":"Li4Mn3CoO8","formula_anonymous":"AB3C4D8","energy":-114.09919395,"energy_per_atom":-7.131199621875,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-101.96119395,"band_gap":1.0659999999999998,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":12.0000554,"is_theoretical":true,"updated_at":"2021-11-28T01:37:41.664000Z","spacegroup":2},{"id":"mp-1176664","created_at":"2022-09-04T14:46:27.329963Z","structure_string":"Li4 Mn12 P12 O48\n1.0\n8.653396 0.000000 0.000000\n-2.113824 8.794335 0.000000\n-2.361604 -3.838276 11.713616\nLi Mn P O\n4 12 12 48\ndirect\n0.498472 0.505956 0.012567 Li\n0.499577 0.248973 0.749206 Li\n0.500921 0.993323 0.488323 Li\n0.991617 0.131878 0.120758 Li\n0.611392 0.890134 0.958218 Mn\n0.260962 0.495242 0.755924 Mn\n0.932927 0.483484 0.866823 Mn\n0.066403 0.016193 0.631804 Mn\n0.385740 0.608574 0.539783 Mn\n0.737857 0.001497 0.741061 Mn\n0.273999 0.981457 0.257697 Mn\n0.613386 0.390355 0.456280 Mn\n0.934577 0.986797 0.371428 Mn\n0.066386 0.520118 0.130858 Mn\n0.733922 0.517606 0.247272 Mn\n0.383964 0.107503 0.042388 Mn\n0.132127 0.240428 0.892082 P\n0.349512 0.883855 0.748703 P\n0.711947 0.268851 0.980436 P\n0.649755 0.615533 0.750679 P\n0.133397 0.741470 0.393720 P\n0.287703 0.231391 0.519956 P\n0.711931 0.773334 0.480503 P\n0.864869 0.259653 0.608320 P\n0.343284 0.372582 0.243411 P\n0.288389 0.726570 0.018761 P\n0.654357 0.123368 0.253930 P\n0.870521 0.764003 0.108345 P\n0.042260 0.360555 0.950036 O\n0.408924 0.928383 0.884118 O\n0.166400 0.633482 0.899006 O\n0.181811 0.153658 0.979564 O\n0.178319 0.908284 0.719296 O\n0.536601 0.266639 0.994718 O\n0.280680 0.333960 0.862273 O\n0.477467 0.991210 0.709570 O\n0.997129 0.383128 0.714644 O\n0.668342 0.796469 0.801558 O\n0.333473 0.703911 0.699703 O\n0.523101 0.509719 0.791651 O\n0.726729 0.348299 0.884662 O\n0.043404 0.859657 0.454062 O\n0.737400 0.100491 0.938128 O\n0.821585 0.592111 0.780973 O\n0.187320 0.649001 0.474320 O\n0.268185 0.400494 0.565945 O\n0.834416 0.866280 0.600627 O\n0.590616 0.572141 0.615923 O\n0.272898 0.151618 0.616242 O\n0.537854 0.773930 0.498201 O\n0.280975 0.839883 0.366193 O\n0.003908 0.888631 0.213486 O\n0.001814 0.115767 0.786044 O\n0.718922 0.163958 0.639849 O\n0.462842 0.231719 0.504732 O\n0.732896 0.858818 0.388937 O\n0.406629 0.427314 0.378349 O\n0.164414 0.133474 0.401965 O\n0.728690 0.603527 0.432072 O\n0.809901 0.348214 0.524868 O\n0.166194 0.389126 0.208199 O\n0.269952 0.895934 0.066843 O\n0.955650 0.141012 0.549458 O\n0.268854 0.642230 0.111111 O\n0.466174 0.461011 0.192123 O\n0.675196 0.305646 0.298341 O\n0.314811 0.187814 0.199847 O\n0.003020 0.620076 0.285280 O\n0.534720 0.032889 0.306181 O\n0.723722 0.664271 0.135546 O\n0.463045 0.726133 0.001927 O\n0.826175 0.095015 0.275843 O\n0.819034 0.867407 0.033170 O\n0.837421 0.363676 0.098721 O\n0.587497 0.070696 0.118252 O\n0.957268 0.644941 0.045478 O\n","nsites":76,"nelements":4,"elements":["Li","Mn","P","O"],"chemical_system":"Li-Mn-O-P","density":3.402751735210658,"density_atomic":0.0852575848612388,"volume":891.4162901012736,"volume_molar":7.063466282561663,"formula_full":"Li4 Mn12 P12 O48","formula_reduced":"LiMn3(PO4)3","formula_anonymous":"AB3C3D12","energy":-609.6582115699999,"energy_per_atom":-8.021818573289472,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-556.66621157,"band_gap":0.2761,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":52.0000002,"is_theoretical":true,"updated_at":"2021-11-28T01:37:34.791000Z","spacegroup":1},{"id":"mp-1176990","created_at":"2022-09-04T14:46:27.330945Z","structure_string":"Li6 V3 Cu1 P6 O24\n1.0\n8.459563 0.000000 0.000000\n3.874703 7.571430 0.000000\n3.979251 2.550825 7.215272\nLi V Cu P O\n6 3 1 6 24\ndirect\n0.014555 0.989545 0.990688 Li\n0.743931 0.146031 0.352576 Li\n0.479979 0.509262 0.498701 Li\n0.218811 0.851868 0.656166 Li\n0.660325 0.210124 0.852541 Li\n0.847937 0.668693 0.202473 Li\n0.141223 0.147182 0.134178 V\n0.359496 0.360622 0.358973 V\n0.643362 0.645810 0.644396 V\n0.853975 0.853110 0.836003 Cu\n0.058920 0.751567 0.446242 P\n0.448455 0.053402 0.756982 P\n0.752499 0.457293 0.046693 P\n0.254393 0.542211 0.959357 P\n0.541906 0.964045 0.256827 P\n0.952154 0.250355 0.535927 P\n0.117188 0.308324 0.490692 O\n0.331736 0.488790 0.110291 O\n0.054172 0.923162 0.260261 O\n0.517774 0.111605 0.327949 O\n0.247833 0.597935 0.410888 O\n0.050020 0.804189 0.596543 O\n0.253917 0.071765 0.912924 O\n0.440842 0.239562 0.590023 O\n0.605652 0.422437 0.243041 O\n0.182464 0.383044 0.999848 O\n0.098185 0.732782 0.947057 O\n0.370122 0.018306 0.198738 O\n0.600103 0.028635 0.824654 O\n0.910979 0.261891 0.066701 O\n0.811385 0.617046 0.018692 O\n0.406659 0.560891 0.763984 O\n0.552943 0.767390 0.411759 O\n0.729897 0.950030 0.100039 O\n0.972088 0.196261 0.377217 O\n0.759978 0.406750 0.565381 O\n0.487422 0.887972 0.701838 O\n0.942753 0.083997 0.724658 O\n0.696115 0.489562 0.886881 O\n0.887852 0.695554 0.492219 O\n","nsites":40,"nelements":5,"elements":["Li","V","Cu","P","O"],"chemical_system":"Cu-Li-O-P-V","density":2.974537217592611,"density_atomic":0.08655286399616681,"volume":462.14530811795544,"volume_molar":6.957760242649745,"formula_full":"Li6 V3 Cu1 P6 O24","formula_reduced":"Li6V3Cu(PO4)6","formula_anonymous":"AB3C6D6E24","energy":-294.6814633,"energy_per_atom":-7.367036582500001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-273.0934633,"band_gap":0.0439000000000002,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.6544769,"is_theoretical":true,"updated_at":"2021-11-28T01:37:37.223000Z","spacegroup":1},{"id":"mp-1189757","created_at":"2022-09-04T14:46:27.973031Z","structure_string":"Dy4 Sn2 S10\n1.0\n3.820780 0.000000 0.000000\n0.000000 7.740163 0.000000\n0.000000 0.000000 11.357977\nDy Sn S\n4 2 10\ndirect\n0.500000 0.532296 0.172220 Dy\n0.500000 0.467704 0.827780 Dy\n0.500000 0.967704 0.672220 Dy\n0.500000 0.032296 0.327780 Dy\n0.000000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.000000 0.000000 0.500000 S\n0.000000 0.500000 0.000000 S\n0.000000 0.824841 0.196062 S\n0.000000 0.175159 0.803938 S\n0.000000 0.675159 0.696062 S\n0.000000 0.324841 0.303938 S\n0.500000 0.671584 0.402291 S\n0.500000 0.328416 0.597709 S\n0.500000 0.828416 0.902291 S\n0.500000 0.171584 0.097709 S\n","nsites":16,"nelements":3,"elements":["Dy","Sn","S"],"chemical_system":"Dy-S-Sn","density":5.9722513023289965,"density_atomic":0.047633978837845516,"volume":335.8946783443564,"volume_molar":12.642531459528987,"formula_full":"Dy4 Sn2 S10","formula_reduced":"Dy2SnS5","formula_anonymous":"AB2C5","energy":-95.40656719,"energy_per_atom":-5.962910449375,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-90.37656719,"band_gap":0.1715999999999997,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0021862,"is_theoretical":false,"updated_at":"2021-11-28T01:37:37.935000Z","spacegroup":55}]}