GET /third-parties/MatprojStructure/?format=api&ordering=energy_above_hull&page=12175
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=energy_above_hull&page=12176",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=energy_above_hull&page=12174",
    "results": [
        {
            "id": "mp-1201660",
            "created_at": "2022-09-04T14:48:28.855228Z",
            "structure_string": "Ho10 Ge20 Os8\n1.0\n13.164534 0.000000 0.000000\n0.000000 13.164534 0.000000\n0.000000 0.000000 4.267019\nHo Ge Os\n10 20 8\ndirect\n0.500000 0.500000 0.000000 Ho\n0.000000 0.000000 0.000000 Ho\n0.671850 0.171850 0.500000 Ho\n0.328150 0.828150 0.500000 Ho\n0.171850 0.328150 0.500000 Ho\n0.828150 0.671850 0.500000 Ho\n0.883348 0.383348 0.500000 Ho\n0.116652 0.616652 0.500000 Ho\n0.383348 0.116652 0.500000 Ho\n0.616652 0.883348 0.500000 Ho\n0.567557 0.067557 0.000000 Ge\n0.432443 0.932443 0.000000 Ge\n0.067557 0.432443 0.000000 Ge\n0.932443 0.567557 0.000000 Ge\n0.663777 0.697795 0.000000 Ge\n0.336223 0.302205 0.000000 Ge\n0.163777 0.802205 0.000000 Ge\n0.836223 0.197795 0.000000 Ge\n0.302205 0.663777 0.000000 Ge\n0.697795 0.336223 0.000000 Ge\n0.197795 0.163777 0.000000 Ge\n0.802205 0.836223 0.000000 Ge\n0.657843 0.508169 0.500000 Ge\n0.342157 0.491831 0.500000 Ge\n0.157843 0.991831 0.500000 Ge\n0.842157 0.008169 0.500000 Ge\n0.491831 0.657843 0.500000 Ge\n0.508169 0.342157 0.500000 Ge\n0.008169 0.157843 0.500000 Ge\n0.991831 0.842157 0.500000 Ge\n0.747722 0.518435 0.000000 Os\n0.252278 0.481565 0.000000 Os\n0.247722 0.981565 0.000000 Os\n0.752278 0.018435 0.000000 Os\n0.481565 0.747722 0.000000 Os\n0.518435 0.252278 0.000000 Os\n0.018435 0.247722 0.000000 Os\n0.981565 0.752278 0.000000 Os\n",
            "nsites": 38,
            "nelements": 3,
            "elements": [
                "Ho",
                "Ge",
                "Os"
            ],
            "chemical_system": "Ge-Ho-Os",
            "density": 10.383075940926936,
            "density_atomic": 0.051386381750241156,
            "volume": 739.495537644498,
            "volume_molar": 11.719332155492225,
            "formula_full": "Ho10 Ge20 Os8",
            "formula_reduced": "Ho5(Ge5Os2)2",
            "formula_anonymous": "A4B5C10",
            "energy": -248.67392543,
            "energy_per_atom": -6.5440506692105265,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -248.67392543,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0240585,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:39:44.372000Z",
            "spacegroup": 127
        },
        {
            "id": "mp-1110751",
            "created_at": "2022-09-04T14:48:28.859684Z",
            "structure_string": "Rb2 Li1 Bi1 I6\n1.0\n0.000000 6.064111 6.064111\n6.064111 0.000000 6.064111\n6.064111 6.064111 0.000000\nRb Li Bi I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Bi\n0.746101 0.253899 0.253899 I\n0.253899 0.253899 0.746101 I\n0.253899 0.746101 0.746101 I\n0.253899 0.746101 0.253899 I\n0.746101 0.253899 0.746101 I\n0.746101 0.746101 0.253899 I\n",
            "nsites": 10,
            "nelements": 4,
            "elements": [
                "Rb",
                "Li",
                "Bi",
                "I"
            ],
            "chemical_system": "Bi-I-Li-Rb",
            "density": 4.275303207183743,
            "density_atomic": 0.022421702079053394,
            "volume": 445.9964709522259,
            "volume_molar": 26.858535265375554,
            "formula_full": "Rb2 Li1 Bi1 I6",
            "formula_reduced": "Rb2LiBiI6",
            "formula_anonymous": "ABC2D6",
            "energy": -29.1756192,
            "energy_per_atom": -2.91756192,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -26.9016192,
            "band_gap": 1.9334,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0048246,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:39:24.580000Z",
            "spacegroup": 225
        },
        {
            "id": "mp-16947",
            "created_at": "2022-09-04T14:48:28.862476Z",
            "structure_string": "Li6 Al6 Ge6 O24\n1.0\n5.085867 -6.978181 0.000000\n5.085867 6.978181 0.000000\n-4.488709 0.000000 7.376486\nLi Al Ge O\n6 6 6 24\ndirect\n0.239583 0.468488 0.071280 Li\n0.468488 0.071280 0.239583 Li\n0.071280 0.239583 0.468488 Li\n0.760417 0.531512 0.928720 Li\n0.531512 0.928720 0.760417 Li\n0.928720 0.760417 0.531512 Li\n0.568110 0.789093 0.384404 Al\n0.384404 0.568110 0.789093 Al\n0.431890 0.210907 0.615596 Al\n0.210907 0.615596 0.431890 Al\n0.615596 0.431890 0.210907 Al\n0.789093 0.384404 0.568110 Al\n0.133221 0.720456 0.893525 Ge\n0.720456 0.893525 0.133221 Ge\n0.106475 0.866779 0.279544 Ge\n0.866779 0.279544 0.106475 Ge\n0.279544 0.106475 0.866779 Ge\n0.893525 0.133221 0.720456 Ge\n0.344840 0.684911 0.659679 O\n0.379287 0.322780 0.048145 O\n0.048145 0.379287 0.322780 O\n0.322780 0.048145 0.379287 O\n0.620713 0.677220 0.951855 O\n0.951855 0.620713 0.677220 O\n0.677220 0.951855 0.620713 O\n0.684911 0.659679 0.344840 O\n0.739792 0.401081 0.079106 O\n0.659679 0.344840 0.684911 O\n0.315089 0.340321 0.655160 O\n0.655160 0.315089 0.340321 O\n0.260208 0.598919 0.920894 O\n0.598919 0.920894 0.260208 O\n0.920894 0.260208 0.598919 O\n0.973124 0.279729 0.955049 O\n0.401081 0.079106 0.739792 O\n0.079106 0.739792 0.401081 O\n0.044951 0.026876 0.720271 O\n0.279729 0.955049 0.973124 O\n0.955049 0.973124 0.279729 O\n0.026876 0.720271 0.044951 O\n0.720271 0.044951 0.026876 O\n0.340321 0.655160 0.315089 O\n",
            "nsites": 42,
            "nelements": 4,
            "elements": [
                "Li",
                "Al",
                "Ge",
                "O"
            ],
            "chemical_system": "Al-Ge-Li-O",
            "density": 3.245571201696215,
            "density_atomic": 0.08021628472679943,
            "volume": 523.584458480514,
            "volume_molar": 7.507379306471502,
            "formula_full": "Li6 Al6 Ge6 O24",
            "formula_reduced": "LiAlGeO4",
            "formula_anonymous": "ABCD4",
            "energy": -293.28567931,
            "energy_per_atom": -6.982992364523809,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -276.79767931,
            "band_gap": 3.3281000000000005,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0004672,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:39:45.178000Z",
            "spacegroup": 148
        },
        {
            "id": "mp-677078",
            "created_at": "2022-09-04T14:48:28.863634Z",
            "structure_string": "Ca11 Al1 Si3 Cl1 O18\n1.0\n0.000000 7.471335 7.509309\n4.425624 0.000000 7.509309\n4.425624 7.471335 0.000000\nCa Al Si Cl O\n11 1 3 1 18\ndirect\n0.293219 0.453002 0.964806 Ca\n0.711027 0.035194 0.546998 Ca\n0.546998 0.706781 0.711027 Ca\n0.004105 0.995895 0.004105 Ca\n0.037470 0.705765 0.703180 Ca\n0.964806 0.288973 0.293219 Ca\n0.446415 0.296820 0.294235 Ca\n0.294235 0.962530 0.446415 Ca\n0.000074 0.500176 0.499824 Ca\n0.703180 0.553585 0.037470 Ca\n0.499824 0.999926 0.000074 Ca\n0.211529 0.788471 0.211529 Al\n0.789203 0.210797 0.789203 Si\n0.212207 0.211211 0.788789 Si\n0.788789 0.787793 0.212207 Si\n0.499006 0.500994 0.499006 Cl\n0.635878 0.182039 0.817961 O\n0.751604 0.748396 0.751604 O\n0.004296 0.701337 0.995472 O\n0.365841 0.182472 0.817528 O\n0.297354 0.702646 0.978611 O\n0.817961 0.364122 0.635878 O\n0.298663 0.995704 0.701105 O\n0.817528 0.634159 0.365841 O\n0.183102 0.363881 0.636119 O\n0.701105 0.004528 0.298663 O\n0.978611 0.021389 0.297354 O\n0.005500 0.994500 0.705713 O\n0.179322 0.625065 0.374935 O\n0.636119 0.816898 0.183102 O\n0.995472 0.298895 0.004296 O\n0.251604 0.248396 0.251604 O\n0.374935 0.820678 0.179322 O\n0.705713 0.294287 0.005500 O\n",
            "nsites": 34,
            "nelements": 5,
            "elements": [
                "Ca",
                "Al",
                "Si",
                "Cl",
                "O"
            ],
            "chemical_system": "Al-Ca-Cl-O-Si",
            "density": 2.9276659476857363,
            "density_atomic": 0.06846619971313204,
            "volume": 496.5954024388283,
            "volume_molar": 8.795786512516091,
            "formula_full": "Ca11 Al1 Si3 Cl1 O18",
            "formula_reduced": "Ca11AlSi3ClO18",
            "formula_anonymous": "ABC3D11E18",
            "energy": -248.04504052,
            "energy_per_atom": -7.295442368235293,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -235.06504052,
            "band_gap": 3.7608,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0013451,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:39:28.682000Z",
            "spacegroup": 42
        },
        {
            "id": "mp-1215947",
            "created_at": "2022-09-04T14:48:28.868955Z",
            "structure_string": "Y1 Lu1 B8 Ir8\n1.0\n5.397527 0.000000 0.000000\n0.000000 5.397527 0.000000\n0.000000 0.000000 7.454301\nY Lu B Ir\n1 1 8 8\ndirect\n0.000000 0.000000 0.500000 Y\n0.500000 0.500000 0.000000 Lu\n0.327143 0.000000 0.153109 B\n0.672857 0.000000 0.153109 B\n0.500000 0.827748 0.653555 B\n0.500000 0.172252 0.653555 B\n0.172252 0.500000 0.346445 B\n0.827748 0.500000 0.346445 B\n0.000000 0.672857 0.846891 B\n0.000000 0.327143 0.846891 B\n0.750735 0.000000 0.856844 Ir\n0.249265 0.000000 0.856844 Ir\n0.500000 0.251529 0.353593 Ir\n0.500000 0.748471 0.353593 Ir\n0.748471 0.500000 0.646407 Ir\n0.251529 0.500000 0.646407 Ir\n0.000000 0.249265 0.143156 Ir\n0.000000 0.750735 0.143156 Ir\n",
            "nsites": 18,
            "nelements": 4,
            "elements": [
                "Y",
                "Lu",
                "B",
                "Ir"
            ],
            "chemical_system": "B-Ir-Lu-Y",
            "density": 14.436994561781765,
            "density_atomic": 0.08288499828724837,
            "volume": 217.16837029565642,
            "volume_molar": 7.2656583030013655,
            "formula_full": "Y1 Lu1 B8 Ir8",
            "formula_reduced": "YLu(BIr)8",
            "formula_anonymous": "ABC8D8",
            "energy": -144.25774255,
            "energy_per_atom": -8.014319030555555,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -144.25774255,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 5.13e-05,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:39:25.969000Z",
            "spacegroup": 115
        },
        {
            "id": "mp-22881",
            "created_at": "2022-09-04T14:48:28.872216Z",
            "structure_string": "Cd1 Cl2\n1.0\n6.416486 -1.962935 0.000000\n6.416486 1.962935 0.000000\n5.815984 0.000000 3.346452\nCd Cl\n1 2\ndirect\n0.000000 0.000000 0.000000 Cd\n0.742279 0.742279 0.742279 Cl\n0.257721 0.257721 0.257721 Cl\n",
            "nsites": 3,
            "nelements": 2,
            "elements": [
                "Cd",
                "Cl"
            ],
            "chemical_system": "Cd-Cl",
            "density": 3.611054751454053,
            "density_atomic": 0.03558799240578588,
            "volume": 84.29809599240728,
            "volume_molar": 16.921833328875618,
            "formula_full": "Cd1 Cl2",
            "formula_reduced": "CdCl2",
            "formula_anonymous": "AB2",
            "energy": -9.10797121,
            "energy_per_atom": -3.0359904033333334,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -7.879971209999999,
            "band_gap": 3.5244,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 4e-06,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:39:44.021000Z",
            "spacegroup": 166
        },
        {
            "id": "mp-1210604",
            "created_at": "2022-09-04T14:48:28.875347Z",
            "structure_string": "Na3 Eu1 V2 O8\n1.0\n2.994124 -5.185975 0.000000\n2.994124 5.185975 0.000000\n0.000000 0.000000 7.327134\nNa Eu V O\n3 1 2 8\ndirect\n0.333333 0.666667 0.693677 Na\n0.666667 0.333333 0.306323 Na\n0.000000 0.000000 0.000000 Na\n0.000000 0.000000 0.500000 Eu\n0.333333 0.666667 0.221400 V\n0.666667 0.333333 0.778600 V\n0.333333 0.666667 0.991610 O\n0.666667 0.333333 0.008390 O\n0.173976 0.826024 0.305360 O\n0.826024 0.173976 0.694640 O\n0.173976 0.347951 0.305360 O\n0.826024 0.652049 0.694640 O\n0.652049 0.826024 0.305360 O\n0.347951 0.173976 0.694640 O\n",
            "nsites": 14,
            "nelements": 4,
            "elements": [
                "Na",
                "Eu",
                "V",
                "O"
            ],
            "chemical_system": "Eu-Na-O-V",
            "density": 3.289877750457627,
            "density_atomic": 0.06152671167936722,
            "volume": 227.5434460557211,
            "volume_molar": 9.78784757973585,
            "formula_full": "Na3 Eu1 V2 O8",
            "formula_reduced": "Na3EuV2O8",
            "formula_anonymous": "AB2C3D8",
            "energy": -106.30173222,
            "energy_per_atom": -7.592980872857143,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -97.40573222,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 5.9606423,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:39:48.698000Z",
            "spacegroup": 164
        },
        {
            "id": "mp-1013987",
            "created_at": "2022-09-04T14:48:28.881981Z",
            "structure_string": "Li4 Ni8 P8 O36\n1.0\n6.257591 0.000000 0.000000\n0.000000 7.437485 0.000000\n0.000000 0.000000 13.852848\nLi Ni P O\n4 8 8 36\ndirect\n0.750000 0.939352 0.777998 Li\n0.750000 0.560648 0.277998 Li\n0.250001 0.439351 0.722002 Li\n0.250001 0.060648 0.222002 Li\n0.750000 0.347938 0.879897 Ni\n0.250001 0.652062 0.120103 Ni\n0.250001 0.847938 0.620103 Ni\n0.750000 0.152062 0.379897 Ni\n0.500000 0.000000 0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.250001 0.362545 0.935042 P\n0.750000 0.637455 0.064959 P\n0.750000 0.862545 0.564958 P\n0.250001 0.137456 0.435042 P\n0.750000 0.399126 0.696248 P\n0.750000 0.100874 0.196248 P\n0.250001 0.899126 0.803752 P\n0.250001 0.600873 0.303752 P\n0.042775 0.580611 0.362045 O\n0.542774 0.419388 0.637955 O\n0.957225 0.080611 0.137955 O\n0.457225 0.919389 0.862045 O\n0.957225 0.419388 0.637955 O\n0.457225 0.580611 0.362045 O\n0.042775 0.919389 0.862045 O\n0.542774 0.080611 0.137955 O\n0.250001 0.314279 0.493850 O\n0.750000 0.685722 0.506150 O\n0.750000 0.814278 0.006149 O\n0.250001 0.185722 0.993850 O\n0.750000 0.135735 0.956331 O\n0.250001 0.864265 0.043668 O\n0.250001 0.635735 0.543668 O\n0.750000 0.364266 0.456332 O\n0.750000 0.218723 0.755122 O\n0.250001 0.781277 0.244879 O\n0.250001 0.718723 0.744878 O\n0.750000 0.281278 0.255121 O\n0.437984 0.135897 0.362256 O\n0.937984 0.864103 0.637744 O\n0.562016 0.635896 0.137744 O\n0.062016 0.364103 0.862256 O\n0.562016 0.864103 0.637744 O\n0.062016 0.135897 0.362256 O\n0.437984 0.364103 0.862256 O\n0.937984 0.635896 0.137744 O\n0.750000 0.469146 0.002383 O\n0.250001 0.037877 0.717285 O\n0.250001 0.462122 0.217285 O\n0.750000 0.537877 0.782715 O\n0.750000 0.030854 0.502383 O\n0.250001 0.969146 0.497617 O\n0.250001 0.530853 0.997616 O\n0.750000 0.962123 0.282715 O\n",
            "nsites": 56,
            "nelements": 4,
            "elements": [
                "Li",
                "Ni",
                "P",
                "O"
            ],
            "chemical_system": "Li-Ni-O-P",
            "density": 3.4025598222156406,
            "density_atomic": 0.08685917123079614,
            "volume": 644.7217859263324,
            "volume_molar": 6.933223831941002,
            "formula_full": "Li4 Ni8 P8 O36",
            "formula_reduced": "LiNi2P2O9",
            "formula_anonymous": "AB2C2D9",
            "energy": -382.61985267,
            "energy_per_atom": -6.832497369107143,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -337.55985267,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 7.7274792,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:39:16.747000Z",
            "spacegroup": 62
        },
        {
            "id": "mp-1096867",
            "created_at": "2022-09-04T14:48:28.899792Z",
            "structure_string": "Cd1 Cu2 Se2\n1.0\n2.007833 -3.477669 0.000000\n2.007833 3.477669 0.000000\n0.000000 0.000000 6.949952\nCd Cu Se\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Cd\n0.666667 0.333333 0.595191 Cu\n0.333333 0.666667 0.404809 Cu\n0.666667 0.333333 0.245149 Se\n0.333333 0.666667 0.754851 Se\n",
            "nsites": 5,
            "nelements": 3,
            "elements": [
                "Cd",
                "Cu",
                "Se"
            ],
            "chemical_system": "Cd-Cu-Se",
            "density": 6.799460608540519,
            "density_atomic": 0.051516028124764766,
            "volume": 97.0571719522065,
            "volume_molar": 11.689839025274232,
            "formula_full": "Cd1 Cu2 Se2",
            "formula_reduced": "Cd(CuSe)2",
            "formula_anonymous": "AB2C2",
            "energy": -18.66770984,
            "energy_per_atom": -3.733541968,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -17.72370984,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0601446,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:39:47.040000Z",
            "spacegroup": 164
        },
        {
            "id": "mp-779446",
            "created_at": "2022-09-04T14:48:28.902454Z",
            "structure_string": "Li6 Mn2 Fe4 B6 O18\n1.0\n3.151513 0.000000 0.000000\n0.000000 8.255019 0.000000\n0.000000 0.022257 14.316086\nLi Mn Fe B O\n6 2 4 6 18\ndirect\n0.500000 0.706404 0.990555 Li\n0.500000 0.659715 0.358372 Li\n0.500000 0.634095 0.650538 Li\n0.500000 0.207022 0.492058 Li\n0.500000 0.158135 0.856406 Li\n0.500000 0.133193 0.151230 Li\n0.000000 0.808425 0.180009 Mn\n0.000000 0.365360 0.005391 Mn\n0.000000 0.864307 0.504539 Fe\n0.000000 0.824967 0.816717 Fe\n0.000000 0.324436 0.317042 Fe\n0.000000 0.311399 0.679844 Fe\n0.500000 0.999869 0.666308 B\n0.000000 0.000195 0.998908 B\n0.500000 0.001119 0.334512 B\n0.500000 0.498113 0.167729 B\n0.000000 0.500229 0.500259 B\n0.500000 0.500992 0.831970 B\n0.500000 0.989195 0.431381 O\n0.500000 0.981368 0.763251 O\n0.500000 0.863670 0.608691 O\n0.500000 0.861489 0.280404 O\n0.000000 0.846463 0.958642 O\n0.500000 0.651124 0.125876 O\n0.500000 0.652774 0.789461 O\n0.000000 0.640029 0.445610 O\n0.000000 0.512067 0.597225 O\n0.500000 0.489561 0.928828 O\n0.500000 0.482991 0.264568 O\n0.500000 0.360756 0.111582 O\n0.500000 0.360902 0.777922 O\n0.000000 0.348510 0.457873 O\n0.500000 0.154795 0.627097 O\n0.500000 0.152751 0.291483 O\n0.000000 0.136745 0.941855 O\n0.000000 0.016832 0.095863 O\n",
            "nsites": 36,
            "nelements": 5,
            "elements": [
                "Li",
                "Mn",
                "Fe",
                "B",
                "O"
            ],
            "chemical_system": "B-Fe-Li-Mn-O",
            "density": 3.244697268686653,
            "density_atomic": 0.09665871606251618,
            "volume": 372.44442577445574,
            "volume_molar": 6.230313214697624,
            "formula_full": "Li6 Mn2 Fe4 B6 O18",
            "formula_reduced": "Li3MnFe2(BO3)3",
            "formula_anonymous": "AB2C3D3E9",
            "energy": -278.96372235,
            "energy_per_atom": -7.7489922875,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -254.23772235,
            "band_gap": 3.1966,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 26.0000001,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:39:15.881000Z",
            "spacegroup": 6
        },
        {
            "id": "mp-1200474",
            "created_at": "2022-09-04T14:48:28.902567Z",
            "structure_string": "B16 P64 H48 O96\n1.0\n9.078574 0.000000 0.000000\n0.000000 16.343838 0.000000\n0.000000 0.000000 24.551940\nB P H O\n16 64 48 96\ndirect\n0.273727 0.224959 0.296676 B\n0.773727 0.275041 0.703324 B\n0.726273 0.724959 0.203324 B\n0.226273 0.775041 0.796676 B\n0.726273 0.775041 0.703324 B\n0.226273 0.724959 0.296676 B\n0.273727 0.275041 0.796676 B\n0.773727 0.224959 0.203324 B\n0.711399 0.924662 0.469471 B\n0.211399 0.575338 0.530529 B\n0.288601 0.424662 0.030529 B\n0.788601 0.075338 0.969471 B\n0.288601 0.075338 0.530529 B\n0.788601 0.424662 0.469471 B\n0.711399 0.575338 0.969471 B\n0.211399 0.924662 0.030529 B\n0.800260 0.011369 0.432347 P\n0.300260 0.488631 0.567653 P\n0.199740 0.511369 0.067653 P\n0.699740 0.988631 0.932347 P\n0.199740 0.988631 0.567653 P\n0.699740 0.511369 0.432347 P\n0.800260 0.488631 0.932347 P\n0.300260 0.011369 0.067653 P\n0.159661 0.133454 0.313614 P\n0.659661 0.366546 0.686386 P\n0.840339 0.633454 0.186386 P\n0.340339 0.866546 0.813614 P\n0.840339 0.866546 0.686386 P\n0.340339 0.633454 0.313614 P\n0.159661 0.366546 0.813614 P\n0.659661 0.133454 0.186386 P\n0.161364 0.966587 0.262204 P\n0.661364 0.533413 0.737796 P\n0.838636 0.466587 0.237796 P\n0.338636 0.033413 0.762204 P\n0.838636 0.033413 0.737796 P\n0.338636 0.466587 0.262204 P\n0.161364 0.533413 0.762204 P\n0.661364 0.966587 0.237796 P\n0.013036 0.905217 0.367654 P\n0.513036 0.594783 0.632346 P\n0.986964 0.405217 0.132346 P\n0.486964 0.094783 0.867654 P\n0.986964 0.094783 0.632346 P\n0.486964 0.405217 0.367654 P\n0.013036 0.594783 0.867654 P\n0.513036 0.905217 0.132346 P\n0.877955 0.176178 0.481315 P\n0.377955 0.323822 0.518685 P\n0.122045 0.676178 0.018685 P\n0.622045 0.823822 0.981315 P\n0.122045 0.823822 0.518685 P\n0.622045 0.676178 0.481315 P\n0.877955 0.323822 0.981315 P\n0.377955 0.176178 0.018685 P\n0.926836 0.236675 0.364215 P\n0.426836 0.263325 0.635785 P\n0.073164 0.736675 0.135785 P\n0.573164 0.763325 0.864215 P\n0.073164 0.763325 0.635785 P\n0.573164 0.736675 0.364215 P\n0.926836 0.263325 0.864215 P\n0.426836 0.236675 0.135785 P\n0.311505 0.988979 0.368012 P\n0.811505 0.511021 0.631988 P\n0.688495 0.488979 0.131988 P\n0.188495 0.011021 0.868012 P\n0.688495 0.011021 0.631988 P\n0.188495 0.488979 0.368012 P\n0.311505 0.511021 0.868012 P\n0.811505 0.988979 0.131988 P\n0.632827 0.165665 0.402098 P\n0.132827 0.334335 0.597902 P\n0.367173 0.665665 0.097902 P\n0.867173 0.834335 0.902098 P\n0.367173 0.834335 0.597902 P\n0.867173 0.665665 0.402098 P\n0.632827 0.334335 0.902098 P\n0.132827 0.165665 0.097902 P\n0.812097 0.885452 0.489014 H\n0.312097 0.614548 0.510986 H\n0.187903 0.385452 0.010986 H\n0.687903 0.114548 0.989014 H\n0.187903 0.114548 0.510986 H\n0.687903 0.385452 0.489014 H\n0.812097 0.614548 0.989014 H\n0.312097 0.885452 0.010986 H\n0.644411 0.889189 0.433566 H\n0.144411 0.610811 0.566434 H\n0.355589 0.389189 0.066434 H\n0.855589 0.110811 0.933566 H\n0.355589 0.110811 0.566434 H\n0.855589 0.389189 0.433566 H\n0.644411 0.610811 0.933566 H\n0.144411 0.889189 0.066434 H\n0.395473 0.198399 0.286326 H\n0.895473 0.301601 0.713674 H\n0.604527 0.698399 0.213674 H\n0.104527 0.801601 0.786326 H\n0.604527 0.801601 0.713674 H\n0.104527 0.698399 0.286326 H\n0.395473 0.301601 0.786326 H\n0.895473 0.198399 0.213674 H\n0.268627 0.260829 0.340341 H\n0.768627 0.239171 0.659659 H\n0.731373 0.760829 0.159659 H\n0.231373 0.739171 0.840341 H\n0.731373 0.739171 0.659659 H\n0.231373 0.760829 0.340341 H\n0.268627 0.239171 0.840341 H\n0.768627 0.260829 0.159659 H\n0.631753 0.957805 0.502610 H\n0.131753 0.542195 0.497390 H\n0.368247 0.457805 0.997390 H\n0.868247 0.042195 0.002610 H\n0.368247 0.042195 0.497390 H\n0.868247 0.457805 0.502610 H\n0.631753 0.542195 0.002610 H\n0.131753 0.957805 0.997390 H\n0.210925 0.260402 0.259952 H\n0.710925 0.239598 0.740048 H\n0.789075 0.760402 0.240048 H\n0.289075 0.739598 0.759952 H\n0.789075 0.739598 0.740048 H\n0.289075 0.760402 0.259952 H\n0.210925 0.239598 0.759952 H\n0.710925 0.260402 0.240048 H\n0.307417 0.961530 0.302706 O\n0.807417 0.538470 0.697294 O\n0.692583 0.461530 0.197294 O\n0.192583 0.038470 0.802706 O\n0.692583 0.038470 0.697294 O\n0.192583 0.461530 0.302706 O\n0.307417 0.538470 0.802706 O\n0.807417 0.961530 0.197294 O\n0.686833 0.067525 0.398489 O\n0.186833 0.432475 0.601511 O\n0.313167 0.567525 0.101511 O\n0.813167 0.932475 0.898489 O\n0.313167 0.932475 0.601511 O\n0.813167 0.567525 0.398489 O\n0.686833 0.432475 0.898489 O\n0.186833 0.067525 0.101511 O\n0.031056 0.930743 0.302914 O\n0.531056 0.569257 0.697086 O\n0.968944 0.430743 0.197086 O\n0.468944 0.069257 0.802914 O\n0.968944 0.069257 0.697086 O\n0.468944 0.430743 0.302914 O\n0.031056 0.569257 0.802914 O\n0.531056 0.930743 0.197086 O\n0.175798 0.931938 0.392297 O\n0.675798 0.568062 0.607703 O\n0.824202 0.431938 0.107703 O\n0.324202 0.068062 0.892297 O\n0.824202 0.068062 0.607703 O\n0.324202 0.431938 0.392297 O\n0.175798 0.568062 0.892297 O\n0.675798 0.931938 0.107703 O\n0.752454 0.209502 0.360361 O\n0.252454 0.290498 0.639639 O\n0.247546 0.709502 0.139639 O\n0.747546 0.790498 0.860361 O\n0.247546 0.790498 0.639639 O\n0.747546 0.709502 0.360361 O\n0.752454 0.290498 0.860361 O\n0.252454 0.209502 0.139639 O\n0.966742 0.213897 0.428310 O\n0.466742 0.286103 0.571690 O\n0.033258 0.713897 0.071690 O\n0.533258 0.786103 0.928310 O\n0.033258 0.786103 0.571690 O\n0.533258 0.713897 0.428310 O\n0.966742 0.286103 0.928310 O\n0.466742 0.213897 0.071690 O\n0.995329 0.151623 0.334542 O\n0.495329 0.348377 0.665458 O\n0.004671 0.651623 0.165458 O\n0.504671 0.848377 0.834542 O\n0.004671 0.848377 0.665458 O\n0.504671 0.651623 0.334542 O\n0.995329 0.348377 0.834542 O\n0.495329 0.151623 0.165458 O\n0.227644 0.079898 0.362785 O\n0.727644 0.420102 0.637215 O\n0.772356 0.579898 0.137215 O\n0.272356 0.920102 0.862785 O\n0.772356 0.920102 0.637215 O\n0.272356 0.579898 0.362785 O\n0.227644 0.420102 0.862785 O\n0.727644 0.079898 0.137215 O\n0.130087 0.067931 0.265663 O\n0.630087 0.432069 0.734337 O\n0.869913 0.567931 0.234337 O\n0.369913 0.932069 0.765663 O\n0.869913 0.932069 0.734337 O\n0.369913 0.567931 0.265663 O\n0.130087 0.432069 0.765663 O\n0.630087 0.067931 0.234337 O\n0.704488 0.190314 0.462009 O\n0.204488 0.309686 0.537991 O\n0.295512 0.690314 0.037991 O\n0.795512 0.809686 0.962009 O\n0.295512 0.809686 0.537991 O\n0.795512 0.690314 0.462009 O\n0.704488 0.309686 0.962009 O\n0.204488 0.190314 0.037991 O\n0.889928 0.074859 0.470123 O\n0.389928 0.425141 0.529877 O\n0.110072 0.574859 0.029877 O\n0.610072 0.925141 0.970123 O\n0.110072 0.925141 0.529877 O\n0.610072 0.574859 0.470123 O\n0.889928 0.425141 0.970123 O\n0.389928 0.074859 0.029877 O\n0.917483 0.988854 0.385771 O\n0.417483 0.511146 0.614229 O\n0.082517 0.488854 0.114229 O\n0.582517 0.011146 0.885771 O\n0.082517 0.011146 0.614229 O\n0.582517 0.488854 0.385771 O\n0.917483 0.511146 0.885771 O\n0.417483 0.988854 0.114229 O\n",
            "nsites": 224,
            "nelements": 4,
            "elements": [
                "B",
                "P",
                "H",
                "O"
            ],
            "chemical_system": "B-H-O-P",
            "density": 1.7045867323454913,
            "density_atomic": 0.06148802128096543,
            "volume": 3642.9859887090347,
            "volume_molar": 9.794006433354275,
            "formula_full": "B16 P64 H48 O96",
            "formula_reduced": "BP4(HO2)3",
            "formula_anonymous": "AB3C4D6",
            "energy": -1423.06744884,
            "energy_per_atom": -6.352979682321428,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -1348.52344884,
            "band_gap": 4.364,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 4e-07,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:39:48.671000Z",
            "spacegroup": 61
        },
        {
            "id": "mp-1516729",
            "created_at": "2022-09-04T14:48:28.874259Z",
            "structure_string": "Na1 Sm1 Mn1 W1 O6\n1.0\n0.000000 -4.015021 -4.015021\n4.015021 0.000000 -4.015021\n4.015021 -4.015021 0.000000\nNa Sm Mn W O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Sm\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 W\n0.740483 0.259517 0.259517 O\n0.259517 0.740483 0.740483 O\n0.740483 0.259517 0.740483 O\n0.259517 0.740483 0.259517 O\n0.740483 0.740483 0.259517 O\n0.259517 0.259517 0.740483 O\n",
            "nsites": 10,
            "nelements": 5,
            "elements": [
                "Na",
                "Sm",
                "Mn",
                "W",
                "O"
            ],
            "chemical_system": "Mn-Na-O-Sm-W",
            "density": 6.518167699006095,
            "density_atomic": 0.07725143240789294,
            "volume": 129.4474379089737,
            "volume_molar": 7.795506921091998,
            "formula_full": "Na1 Sm1 Mn1 W1 O6",
            "formula_reduced": "NaSmMnWO6",
            "formula_anonymous": "ABCDE6",
            "energy": -82.41289452999999,
            "energy_per_atom": -8.241289452999998,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -72.18489453,
            "band_gap": 0.9514000000000004,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 5.0000007,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:39:44.300000Z",
            "spacegroup": 216
        }
    ]
}