GET /third-parties/MatprojStructure/?format=api&ordering=-formula_anonymous&page=50
HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept

{
    "count": 146323,
    "next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-formula_anonymous&page=51",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-formula_anonymous&page=49",
    "results": [
        {
            "id": "mp-1227097",
            "created_at": "2022-09-04T14:39:35.445549Z",
            "structure_string": "Ca2 Sc2 Al2 Si2 O12\n1.0\n4.549155 5.015991 0.000000\n-4.549155 5.015991 0.000000\n0.000000 1.535755 5.305202\nCa Sc Al Si O\n2 2 2 2 12\ndirect\n0.307734 0.692266 0.500000 Ca\n0.687570 0.312430 0.000000 Ca\n0.902200 0.097800 0.500000 Sc\n0.097865 0.902135 0.000000 Sc\n0.803977 0.619798 0.480271 Al\n0.380202 0.196023 0.519729 Al\n0.202051 0.383510 0.016355 Si\n0.616490 0.797949 0.983645 Si\n0.986742 0.802399 0.380487 O\n0.197601 0.013258 0.619513 O\n0.031580 0.210715 0.103602 O\n0.789285 0.968420 0.896398 O\n0.886281 0.371919 0.588909 O\n0.628081 0.113719 0.411091 O\n0.112253 0.613557 0.925811 O\n0.386443 0.887747 0.074189 O\n0.662946 0.630616 0.235539 O\n0.369384 0.337054 0.764461 O\n0.327860 0.376545 0.245584 O\n0.623455 0.672140 0.754416 O\n",
            "nsites": 20,
            "nelements": 5,
            "elements": [
                "Ca",
                "Sc",
                "Al",
                "Si",
                "O"
            ],
            "chemical_system": "Al-Ca-O-Sc-Si",
            "density": 3.238551467660917,
            "density_atomic": 0.08260580965408958,
            "volume": 242.11372158628623,
            "volume_molar": 7.290214556600331,
            "formula_full": "Ca2 Sc2 Al2 Si2 O12",
            "formula_reduced": "CaScAlSiO6",
            "formula_anonymous": "ABCDE6",
            "energy": -166.06252771,
            "energy_per_atom": -8.3031263855,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -157.81852771,
            "band_gap": 4.6365,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.000327,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:38.553000Z",
            "spacegroup": 5
        },
        {
            "id": "mp-1517893",
            "created_at": "2022-09-04T14:47:11.681971Z",
            "structure_string": "Na1 Sr1 Nb1 Bi1 O6\n1.0\n0.000000 -4.209668 -4.209668\n4.209668 0.000000 -4.209668\n4.209668 -4.209668 0.000000\nNa Sr Nb Bi O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Na\n0.750000 0.750000 0.750000 Sr\n0.500000 0.500000 0.500000 Nb\n0.000000 0.000000 0.000000 Bi\n0.737594 0.262406 0.262406 O\n0.262406 0.737594 0.737594 O\n0.737594 0.262406 0.737594 O\n0.262406 0.737594 0.262406 O\n0.737594 0.737594 0.262406 O\n0.262406 0.262406 0.737594 O\n",
            "nsites": 10,
            "nelements": 5,
            "elements": [
                "Na",
                "Sr",
                "Nb",
                "Bi",
                "O"
            ],
            "chemical_system": "Bi-Na-Nb-O-Sr",
            "density": 5.659271102788121,
            "density_atomic": 0.06702340168142937,
            "volume": 149.201618376985,
            "volume_molar": 8.985131474860065,
            "formula_full": "Na1 Sr1 Nb1 Bi1 O6",
            "formula_reduced": "NaSrNbBiO6",
            "formula_anonymous": "ABCDE6",
            "energy": -70.97898463,
            "energy_per_atom": -7.097898463,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -66.85698463,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0001507,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:58.481000Z",
            "spacegroup": 216
        },
        {
            "id": "mp-1521395",
            "created_at": "2022-09-04T14:47:17.672873Z",
            "structure_string": "Na1 Eu1 Ti1 Bi1 O6\n1.0\n0.000000 -4.068330 -4.068330\n4.068330 -0.000000 -4.068330\n4.068330 -4.068330 -0.000000\nNa Eu Ti Bi O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Na\n0.750000 0.750000 0.750000 Eu\n0.500000 0.500000 0.500000 Ti\n-0.000000 -0.000000 -0.000000 Bi\n0.740235 0.259765 0.259765 O\n0.259765 0.740235 0.740235 O\n0.740235 0.259765 0.740235 O\n0.259765 0.740235 0.259765 O\n0.740235 0.740235 0.259765 O\n0.259765 0.259765 0.740235 O\n",
            "nsites": 10,
            "nelements": 5,
            "elements": [
                "Na",
                "Eu",
                "Ti",
                "Bi",
                "O"
            ],
            "chemical_system": "Bi-Eu-Na-O-Ti",
            "density": 6.507856498935707,
            "density_atomic": 0.07425427886960213,
            "volume": 134.67237379762304,
            "volume_molar": 8.110159914926216,
            "formula_full": "Na1 Eu1 Ti1 Bi1 O6",
            "formula_reduced": "NaEuTiBiO6",
            "formula_anonymous": "ABCDE6",
            "energy": -77.64576852,
            "energy_per_atom": -7.764576852,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -73.52376852,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 6.7109448,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:38:04.732000Z",
            "spacegroup": 216
        },
        {
            "id": "mp-1517370",
            "created_at": "2022-09-04T14:40:42.110613Z",
            "structure_string": "Ba1 Na1 Tb1 W1 O6\n1.0\n-0.000000 -4.219913 -4.219913\n4.219913 0.000000 -4.219913\n4.219913 -4.219913 -0.000000\nBa Na Tb W O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 0.500000 W\n0.731980 0.268020 0.268020 O\n0.268020 0.731980 0.731980 O\n0.731980 0.268020 0.731980 O\n0.268020 0.731980 0.268020 O\n0.731980 0.731980 0.268020 O\n0.268020 0.268020 0.731980 O\n",
            "nsites": 10,
            "nelements": 5,
            "elements": [
                "Ba",
                "Na",
                "Tb",
                "W",
                "O"
            ],
            "chemical_system": "Ba-Na-O-Tb-W",
            "density": 6.618999637085073,
            "density_atomic": 0.06653643259751062,
            "volume": 150.29360020684575,
            "volume_molar": 9.050892157727901,
            "formula_full": "Ba1 Na1 Tb1 W1 O6",
            "formula_reduced": "BaNaTbWO6",
            "formula_anonymous": "ABCDE6",
            "energy": -79.71744724,
            "energy_per_atom": -7.971744724,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -71.15744724,
            "band_gap": 2.8478000000000003,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:09.781000Z",
            "spacegroup": 216
        },
        {
            "id": "mp-1517500",
            "created_at": "2022-09-04T14:46:11.166088Z",
            "structure_string": "Na1 Eu1 Bi1 W1 O6\n1.0\n-0.000000 -4.253243 -4.253243\n4.253243 0.000000 -4.253243\n4.253243 -4.253243 0.000000\nNa Eu Bi W O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Na\n0.750000 0.750000 0.750000 Eu\n0.000000 0.000000 0.000000 Bi\n0.500000 0.500000 0.500000 W\n0.729003 0.270997 0.270997 O\n0.270997 0.729003 0.729003 O\n0.729003 0.270997 0.729003 O\n0.270997 0.729003 0.270997 O\n0.729003 0.729003 0.270997 O\n0.270997 0.270997 0.729003 O\n",
            "nsites": 10,
            "nelements": 5,
            "elements": [
                "Na",
                "Eu",
                "Bi",
                "W",
                "O"
            ],
            "chemical_system": "Bi-Eu-Na-O-W",
            "density": 7.162695791093456,
            "density_atomic": 0.06498444535846112,
            "volume": 153.88297837796313,
            "volume_molar": 9.267049563601304,
            "formula_full": "Na1 Eu1 Bi1 W1 O6",
            "formula_reduced": "NaEuBiWO6",
            "formula_anonymous": "ABCDE6",
            "energy": -80.18084094,
            "energy_per_atom": -8.018084093999999,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -71.62084094,
            "band_gap": 0.6296999999999997,
            "is_gap_direct": true,
            "is_magnetic": true,
            "total_magnetization": 7.0000001,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:18.003000Z",
            "spacegroup": 216
        },
        {
            "id": "mp-1516456",
            "created_at": "2022-09-04T14:39:38.772535Z",
            "structure_string": "K1 Pr1 Eu1 W1 O6\n1.0\n0.000000 -4.295136 -4.295136\n4.295136 -0.000000 -4.295136\n4.295136 -4.295136 0.000000\nK Pr Eu W O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n-0.000000 -0.000000 -0.000000 Pr\n0.750000 0.750000 0.750000 Eu\n0.500000 0.500000 0.500000 W\n0.727275 0.272725 0.272725 O\n0.272725 0.727275 0.727275 O\n0.727275 0.272725 0.727275 O\n0.272725 0.727275 0.272725 O\n0.727275 0.727275 0.272725 O\n0.272725 0.272725 0.727275 O\n",
            "nsites": 10,
            "nelements": 5,
            "elements": [
                "K",
                "Pr",
                "Eu",
                "W",
                "O"
            ],
            "chemical_system": "Eu-K-O-Pr-W",
            "density": 6.4106537825926475,
            "density_atomic": 0.06310143635439666,
            "volume": 158.47499799904696,
            "volume_molar": 9.54358744890979,
            "formula_full": "K1 Pr1 Eu1 W1 O6",
            "formula_reduced": "KPrEuWO6",
            "formula_anonymous": "ABCDE6",
            "energy": -86.85184159,
            "energy_per_atom": -8.685184159,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -78.29184159,
            "band_gap": 0.5705999999999998,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 6.9999999,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:42.318000Z",
            "spacegroup": 216
        },
        {
            "id": "mp-1518460",
            "created_at": "2022-09-04T14:41:35.427132Z",
            "structure_string": "Ba2 Nd2 Eu2 Nb2 O12\n1.0\n6.051590 0.013842 0.018253\n0.017278 6.111222 -0.028276\n0.030073 -0.035915 8.600799\nBa Nd Eu Nb O\n2 2 2 2 12\ndirect\n0.992180 0.031616 0.249986 Ba\n0.007820 0.968384 0.750014 Ba\n0.500000 -0.000000 -0.000000 Nd\n0.000000 0.500000 0.500000 Nd\n0.508145 0.539575 0.251586 Eu\n0.491855 0.460425 0.748414 Eu\n0.000000 0.500000 -0.000000 Nb\n0.500000 -0.000000 0.500000 Nb\n0.195176 0.233281 0.958123 O\n0.314317 0.723634 0.544358 O\n0.804824 0.766719 0.041877 O\n0.685683 0.276366 0.455642 O\n0.272506 0.689381 0.954196 O\n0.234457 0.198348 0.539291 O\n0.727494 0.310619 0.045804 O\n0.765543 0.801652 0.460709 O\n0.430068 0.970839 0.268930 O\n0.090983 0.488752 0.230331 O\n0.569932 0.029161 0.731070 O\n0.909017 0.511248 0.769669 O\n",
            "nsites": 20,
            "nelements": 5,
            "elements": [
                "Ba",
                "Nd",
                "Eu",
                "Nb",
                "O"
            ],
            "chemical_system": "Ba-Eu-Nb-Nd-O",
            "density": 6.499098196982975,
            "density_atomic": 0.06287955388557373,
            "volume": 318.0684143592269,
            "volume_molar": 9.577263812906347,
            "formula_full": "Ba2 Nd2 Eu2 Nb2 O12",
            "formula_reduced": "BaNdEuNbO6",
            "formula_anonymous": "ABCDE6",
            "energy": -180.59722321000004,
            "energy_per_atom": -9.029861160500001,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -172.35322321,
            "band_gap": 0.1223,
            "is_gap_direct": true,
            "is_magnetic": true,
            "total_magnetization": 13.9999907,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:30.784000Z",
            "spacegroup": 2
        },
        {
            "id": "mp-1517051",
            "created_at": "2022-09-04T14:39:41.891615Z",
            "structure_string": "K4 Sr4 Pr4 Bi4 O24\n1.0\n8.797468 0.000000 0.000000\n0.000000 8.766556 0.000000\n0.000000 0.000000 8.858907\nK Sr Pr Bi O\n4 4 4 4 24\ndirect\n0.500000 -0.000000 0.500000 K\n0.500000 0.500000 -0.000000 K\n-0.000000 0.500000 0.000000 K\n-0.000000 -0.000000 0.500000 K\n-0.000000 0.500000 0.500000 Sr\n0.500000 -0.000000 0.000000 Sr\n-0.000000 -0.000000 -0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.250000 0.250000 0.250000 Pr\n0.750000 0.750000 0.250000 Pr\n0.750000 0.250000 0.750000 Pr\n0.250000 0.750000 0.750000 Pr\n0.750000 0.750000 0.750000 Bi\n0.250000 0.250000 0.750000 Bi\n0.250000 0.750000 0.250000 Bi\n0.750000 0.250000 0.250000 Bi\n0.987313 0.217091 0.276170 O\n0.012687 0.782909 0.276170 O\n0.012687 0.217091 0.723830 O\n0.987313 0.782909 0.723830 O\n0.280203 0.987468 0.198951 O\n0.280203 0.012532 0.801049 O\n0.719797 0.012532 0.198951 O\n0.719797 0.987468 0.801049 O\n0.213054 0.267608 0.987237 O\n0.786946 0.267608 0.012763 O\n0.213054 0.732392 0.012763 O\n0.786946 0.732392 0.987237 O\n0.512687 0.282909 0.223830 O\n0.487313 0.717091 0.223830 O\n0.487313 0.282909 0.776170 O\n0.512687 0.717091 0.776170 O\n0.219797 0.512532 0.301049 O\n0.219797 0.487468 0.698951 O\n0.780203 0.487468 0.301049 O\n0.780203 0.512532 0.698951 O\n0.286946 0.232392 0.512763 O\n0.713054 0.232392 0.487237 O\n0.286946 0.767608 0.487237 O\n0.713054 0.767608 0.512763 O\n",
            "nsites": 40,
            "nelements": 5,
            "elements": [
                "K",
                "Sr",
                "Pr",
                "Bi",
                "O"
            ],
            "chemical_system": "Bi-K-O-Pr-Sr",
            "density": 5.566672461527627,
            "density_atomic": 0.05854544907393473,
            "volume": 683.2298775176458,
            "volume_molar": 10.286266234622056,
            "formula_full": "K4 Sr4 Pr4 Bi4 O24",
            "formula_reduced": "KSrPrBiO6",
            "formula_anonymous": "ABCDE6",
            "energy": -256.69467972,
            "energy_per_atom": -6.417366993,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -240.20667972,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 4.0000216,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:27.820000Z",
            "spacegroup": 48
        },
        {
            "id": "mp-1516690",
            "created_at": "2022-09-04T14:39:38.623512Z",
            "structure_string": "Ba1 Li1 Ce1 Sb1 O6\n1.0\n0.000000 -4.235196 -4.235196\n4.235196 0.000000 -4.235196\n4.235196 -4.235196 0.000000\nBa Li Ce Sb O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Li\n-0.000000 -0.000000 -0.000000 Ce\n0.500000 0.500000 0.500000 Sb\n0.737282 0.262718 0.262718 O\n0.262718 0.737282 0.737282 O\n0.737282 0.262718 0.737282 O\n0.262718 0.737282 0.262718 O\n0.737282 0.737282 0.262718 O\n0.262718 0.262718 0.737282 O\n",
            "nsites": 10,
            "nelements": 5,
            "elements": [
                "Ba",
                "Li",
                "Ce",
                "Sb",
                "O"
            ],
            "chemical_system": "Ba-Ce-Li-O-Sb",
            "density": 5.488121590033762,
            "density_atomic": 0.06581872467262101,
            "volume": 151.93244855076563,
            "volume_molar": 9.149585911841685,
            "formula_full": "Ba1 Li1 Ce1 Sb1 O6",
            "formula_reduced": "BaLiCeSbO6",
            "formula_anonymous": "ABCDE6",
            "energy": -71.29726555,
            "energy_per_atom": -7.129726555,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -67.17526555,
            "band_gap": 1.9094,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:25.722000Z",
            "spacegroup": 216
        },
        {
            "id": "mp-1520398",
            "created_at": "2022-09-04T14:43:33.290466Z",
            "structure_string": "Sr2 Ca2 Tb2 Bi2 O12\n1.0\n5.870877 0.004547 0.005880\n0.009468 6.038862 -0.000981\n0.016312 0.004751 8.417175\nSr Ca Tb Bi O\n2 2 2 2 12\ndirect\n0.511379 0.550580 0.249991 Sr\n0.488621 0.449420 0.750009 Sr\n0.986158 0.048844 0.248497 Ca\n0.013842 0.951156 0.751503 Ca\n0.500000 0.000000 0.000000 Tb\n0.000000 0.500000 0.500000 Tb\n0.000000 0.500000 0.000000 Bi\n0.500000 0.000000 0.500000 Bi\n0.185429 0.203849 0.936959 O\n0.309782 0.707509 0.554334 O\n0.814571 0.796151 0.063041 O\n0.690218 0.292491 0.445666 O\n0.294871 0.696007 0.949498 O\n0.203804 0.191527 0.563849 O\n0.705129 0.303993 0.050502 O\n0.796196 0.808473 0.436151 O\n0.380058 0.966299 0.258571 O\n0.098000 0.441250 0.242059 O\n0.619942 0.033701 0.741429 O\n0.902000 0.558750 0.757941 O\n",
            "nsites": 20,
            "nelements": 5,
            "elements": [
                "Sr",
                "Ca",
                "Tb",
                "Bi",
                "O"
            ],
            "chemical_system": "Bi-Ca-O-Sr-Tb",
            "density": 6.583915605275704,
            "density_atomic": 0.06702037945837713,
            "volume": 298.41669297651407,
            "volume_molar": 8.985536651191355,
            "formula_full": "Sr2 Ca2 Tb2 Bi2 O12",
            "formula_reduced": "SrCaTbBiO6",
            "formula_anonymous": "ABCDE6",
            "energy": -140.71760474,
            "energy_per_atom": -7.035880237000001,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -132.47360474,
            "band_gap": 1.7765,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:29.888000Z",
            "spacegroup": 2
        },
        {
            "id": "mp-1516358",
            "created_at": "2022-09-04T14:46:56.709822Z",
            "structure_string": "Ba1 Na1 Bi1 W1 O6\n1.0\n0.000000 -4.282608 -4.282608\n4.282608 -0.000000 -4.282608\n4.282608 -4.282608 0.000000\nBa Na Bi W O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Na\n-0.000000 -0.000000 -0.000000 Bi\n0.500000 0.500000 0.500000 W\n0.727998 0.272002 0.272002 O\n0.272002 0.727998 0.727998 O\n0.727998 0.272002 0.727998 O\n0.272002 0.727998 0.272002 O\n0.727998 0.727998 0.272002 O\n0.272002 0.272002 0.727998 O\n",
            "nsites": 10,
            "nelements": 5,
            "elements": [
                "Ba",
                "Na",
                "Bi",
                "W",
                "O"
            ],
            "chemical_system": "Ba-Bi-Na-O-W",
            "density": 6.861644265921904,
            "density_atomic": 0.06365683363832413,
            "volume": 157.09232502540897,
            "volume_molar": 9.460320936186834,
            "formula_full": "Ba1 Na1 Bi1 W1 O6",
            "formula_reduced": "BaNaBiWO6",
            "formula_anonymous": "ABCDE6",
            "energy": -72.52600071,
            "energy_per_atom": -7.252600071000001,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -63.96600071,
            "band_gap": 2.2936,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:47.063000Z",
            "spacegroup": 216
        },
        {
            "id": "mp-1523298",
            "created_at": "2022-09-04T14:46:02.728114Z",
            "structure_string": "K1 La1 Nb1 In1 O6\n1.0\n-0.000000 -4.126772 -4.126772\n4.126772 -0.000000 -4.126772\n4.126772 -4.126772 0.000000\nK La Nb In O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 La\n0.500000 0.500000 0.500000 Nb\n0.000000 0.000000 0.000000 In\n0.741659 0.258341 0.258341 O\n0.258341 0.741659 0.741659 O\n0.741659 0.258341 0.741659 O\n0.258341 0.741659 0.258341 O\n0.741659 0.741659 0.258341 O\n0.258341 0.258341 0.741659 O\n",
            "nsites": 10,
            "nelements": 5,
            "elements": [
                "K",
                "La",
                "Nb",
                "In",
                "O"
            ],
            "chemical_system": "In-K-La-Nb-O",
            "density": 5.690972092238781,
            "density_atomic": 0.07114404904740118,
            "volume": 140.5598941007321,
            "volume_molar": 8.464714674853022,
            "formula_full": "K1 La1 Nb1 In1 O6",
            "formula_reduced": "KLaNbInO6",
            "formula_anonymous": "ABCDE6",
            "energy": -76.3305205,
            "energy_per_atom": -7.633052050000001,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -72.2085205,
            "band_gap": 2.5501000000000005,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:15.372000Z",
            "spacegroup": 216
        }
    ]
}