GET /third-parties/MatprojStructure/?format=api&ordering=is_theoretical&page=10167
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=is_theoretical&page=10168",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=is_theoretical&page=10166",
    "results": [
        {
            "id": "mp-1027714",
            "created_at": "2022-09-04T14:39:10.323228Z",
            "structure_string": "Mo3 W1 Se4 S4\n1.0\n1.626731 -2.817581 0.000000\n1.626731 2.817581 0.000000\n0.000000 0.000000 36.860572\nMo W Se S\n3 1 4 4\ndirect\n0.333333 0.666667 0.093898 Mo\n0.333333 0.666667 0.469662 Mo\n0.666667 0.333333 0.281821 Mo\n0.666667 0.333333 0.657539 W\n0.333333 0.666667 0.327859 Se\n0.666667 0.333333 0.047813 Se\n0.666667 0.333333 0.139999 Se\n0.333333 0.666667 0.235741 Se\n0.333333 0.666667 0.699571 S\n0.666667 0.333333 0.427769 S\n0.666667 0.333333 0.511577 S\n0.333333 0.666667 0.615499 S\n",
            "nsites": 12,
            "nelements": 4,
            "elements": [
                "Mo",
                "W",
                "Se",
                "S"
            ],
            "chemical_system": "Mo-S-Se-W",
            "density": 4.500352667744398,
            "density_atomic": 0.03551379039595186,
            "volume": 337.8969089530881,
            "volume_molar": 16.957189567370005,
            "formula_full": "Mo3 W1 Se4 S4",
            "formula_reduced": "Mo3W(SeS)4",
            "formula_anonymous": "AB3C4D4",
            "energy": -88.84717001,
            "energy_per_atom": -7.403930834166666,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -84.94717001,
            "band_gap": 0.6261000000000001,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0002951,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:40.301000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-1200378",
            "created_at": "2022-09-04T14:39:10.324873Z",
            "structure_string": "Ce4 B28 I4 O60\n1.0\n17.478143 0.000000 0.000000\n0.000000 8.214567 0.000000\n0.000000 8.123141 9.870657\nCe B I O\n4 28 4 60\ndirect\n0.816214 0.433992 0.747485 Ce\n0.683786 0.433992 0.247485 Ce\n0.183786 0.566008 0.252515 Ce\n0.316214 0.566008 0.752515 Ce\n0.915618 0.096927 0.215097 B\n0.584382 0.096927 0.715097 B\n0.084382 0.903073 0.784903 B\n0.415618 0.903073 0.284903 B\n0.804514 0.932430 0.365341 B\n0.695486 0.932430 0.865341 B\n0.195486 0.067570 0.634659 B\n0.304514 0.067570 0.134659 B\n0.798656 0.848502 0.747810 B\n0.701344 0.848502 0.247810 B\n0.201344 0.151498 0.252190 B\n0.298656 0.151498 0.752190 B\n0.787785 0.195342 0.107937 B\n0.712215 0.195342 0.607937 B\n0.212215 0.804658 0.892063 B\n0.287785 0.804658 0.392063 B\n0.751054 0.570082 0.476277 B\n0.748946 0.570082 0.976277 B\n0.248946 0.429918 0.523723 B\n0.251054 0.429918 0.023723 B\n0.944368 0.919150 0.727016 B\n0.555632 0.919150 0.227016 B\n0.055632 0.080850 0.272984 B\n0.444368 0.080850 0.772984 B\n0.728421 0.044649 0.004055 B\n0.771579 0.044649 0.504055 B\n0.271579 0.955351 0.995945 B\n0.228421 0.955351 0.495945 B\n0.560144 0.605480 0.694246 I\n0.939856 0.605480 0.194246 I\n0.439856 0.394520 0.305754 I\n0.060144 0.394520 0.805754 I\n0.871279 0.900150 0.773047 O\n0.628721 0.900150 0.273047 O\n0.128721 0.099850 0.226953 O\n0.371279 0.099850 0.726953 O\n0.782425 0.716139 0.483981 O\n0.717575 0.716139 0.983981 O\n0.217575 0.283861 0.516019 O\n0.282425 0.283861 0.016019 O\n0.761860 0.207500 0.993128 O\n0.738140 0.207500 0.493128 O\n0.238140 0.792500 0.006872 O\n0.261860 0.792500 0.506872 O\n0.736304 0.986301 0.739670 O\n0.763696 0.986301 0.239670 O\n0.263696 0.013699 0.260330 O\n0.236304 0.013699 0.760330 O\n0.795521 0.862656 0.626620 O\n0.704479 0.862656 0.126620 O\n0.204479 0.137344 0.373380 O\n0.295521 0.137344 0.873380 O\n0.993820 0.121569 0.192024 O\n0.506180 0.121569 0.692024 O\n0.006180 0.878431 0.807976 O\n0.493820 0.878431 0.307976 O\n0.869256 0.221453 0.102953 O\n0.630744 0.221453 0.602953 O\n0.130744 0.778547 0.897047 O\n0.369256 0.778547 0.397047 O\n0.885695 0.951761 0.342928 O\n0.614305 0.951761 0.842928 O\n0.114305 0.048239 0.657072 O\n0.385695 0.048239 0.157072 O\n0.752209 0.366814 0.597990 O\n0.747791 0.366814 0.097990 O\n0.247791 0.633186 0.402010 O\n0.252209 0.633186 0.902010 O\n0.961574 0.474976 0.815974 O\n0.538426 0.474976 0.315974 O\n0.038426 0.525024 0.184026 O\n0.461574 0.525024 0.684026 O\n0.779184 0.623913 0.859001 O\n0.720816 0.623913 0.359001 O\n0.220816 0.376087 0.140999 O\n0.279184 0.376087 0.640999 O\n0.890873 0.198954 0.841984 O\n0.609127 0.198954 0.341984 O\n0.109127 0.801046 0.158016 O\n0.390873 0.801046 0.658016 O\n0.724542 0.084467 0.882399 O\n0.775458 0.084467 0.382399 O\n0.275458 0.915533 0.117601 O\n0.224542 0.915533 0.617601 O\n0.917217 0.510785 0.634627 O\n0.582783 0.510785 0.134627 O\n0.082783 0.489215 0.365373 O\n0.417217 0.489215 0.865373 O\n0.952252 0.973250 0.602557 O\n0.547748 0.973250 0.102557 O\n0.047748 0.026750 0.397443 O\n0.452252 0.026750 0.897443 O\n",
            "nsites": 96,
            "nelements": 4,
            "elements": [
                "Ce",
                "B",
                "I",
                "O"
            ],
            "chemical_system": "B-Ce-I-O",
            "density": 2.7309860906327854,
            "density_atomic": 0.06774000243557769,
            "volume": 1417.1832971411275,
            "volume_molar": 8.890080518859142,
            "formula_full": "Ce4 B28 I4 O60",
            "formula_reduced": "CeB7IO15",
            "formula_anonymous": "ABC7D15",
            "energy": -740.52713958,
            "energy_per_atom": -7.713824370625001,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -699.30713958,
            "band_gap": 0.2577,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 3.4634524,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:42.245000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-1207976",
            "created_at": "2022-09-04T14:39:10.327354Z",
            "structure_string": "Tm4 Co4 B16\n1.0\n3.350687 0.000000 0.000000\n0.000000 5.866956 0.000000\n0.000000 0.000000 11.352771\nTm Co B\n4 4 16\ndirect\n0.500000 0.372505 0.149879 Tm\n0.500000 0.627495 0.850121 Tm\n0.500000 0.127495 0.649879 Tm\n0.500000 0.872505 0.350121 Tm\n0.500000 0.364946 0.410437 Co\n0.500000 0.635054 0.589563 Co\n0.500000 0.135054 0.910437 Co\n0.500000 0.864946 0.089563 Co\n0.000000 0.111880 0.046394 B\n0.000000 0.888120 0.953606 B\n0.000000 0.388120 0.546394 B\n0.000000 0.611880 0.453606 B\n0.000000 0.137927 0.467851 B\n0.000000 0.862073 0.532149 B\n0.000000 0.362073 0.967851 B\n0.000000 0.637927 0.032149 B\n0.000000 0.023437 0.191630 B\n0.000000 0.976563 0.808370 B\n0.000000 0.476563 0.691630 B\n0.000000 0.523437 0.308370 B\n0.000000 0.217218 0.314770 B\n0.000000 0.782782 0.685230 B\n0.000000 0.282782 0.814770 B\n0.000000 0.717218 0.185230 B\n",
            "nsites": 24,
            "nelements": 3,
            "elements": [
                "Tm",
                "Co",
                "B"
            ],
            "chemical_system": "B-Co-Tm",
            "density": 8.068788037485175,
            "density_atomic": 0.10753817754247268,
            "volume": 223.17655504735603,
            "volume_molar": 5.600002620112777,
            "formula_full": "Tm4 Co4 B16",
            "formula_reduced": "TmCoB4",
            "formula_anonymous": "ABC4",
            "energy": -168.2228364,
            "energy_per_atom": -7.00928485,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -168.2228364,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 5.17e-05,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:28.207000Z",
            "spacegroup": 55
        },
        {
            "id": "mp-1245390",
            "created_at": "2022-09-04T14:39:10.328560Z",
            "structure_string": "Ba22 Si4 N20\n1.0\n16.973706 0.000000 0.000000\n0.000000 16.973706 0.000000\n0.000000 0.000000 4.142689\nBa Si N\n22 4 20\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.982428 0.794892 0.500000 Ba\n0.017572 0.205108 0.500000 Ba\n0.517572 0.294892 0.000000 Ba\n0.482428 0.705108 0.000000 Ba\n0.794892 0.982428 0.500000 Ba\n0.205108 0.017572 0.500000 Ba\n0.294892 0.517572 0.000000 Ba\n0.705108 0.482428 0.000000 Ba\n0.670252 0.670252 0.500000 Ba\n0.329748 0.329748 0.500000 Ba\n0.829748 0.170252 0.000000 Ba\n0.170252 0.829748 0.000000 Ba\n0.379297 0.890955 0.500000 Ba\n0.620703 0.109045 0.500000 Ba\n0.120703 0.390955 0.000000 Ba\n0.879297 0.609045 0.000000 Ba\n0.890955 0.379297 0.500000 Ba\n0.109045 0.620703 0.500000 Ba\n0.390955 0.120703 0.000000 Ba\n0.609045 0.879297 0.000000 Ba\n0.314423 0.685577 0.500000 Si\n0.685577 0.314423 0.500000 Si\n0.185577 0.185577 0.000000 Si\n0.814423 0.814423 0.000000 Si\n0.092602 0.907398 0.500000 N\n0.907398 0.092602 0.500000 N\n0.407398 0.407398 0.000000 N\n0.592602 0.592602 0.000000 N\n0.473206 0.185376 0.500000 N\n0.526794 0.814624 0.500000 N\n0.026794 0.685376 0.000000 N\n0.973206 0.314624 0.000000 N\n0.185376 0.473206 0.500000 N\n0.814624 0.526794 0.500000 N\n0.685376 0.026794 0.000000 N\n0.314624 0.973206 0.000000 N\n0.247001 0.752999 0.500000 N\n0.752999 0.247001 0.500000 N\n0.252999 0.252999 0.000000 N\n0.747001 0.747001 0.000000 N\n0.382133 0.617867 0.500000 N\n0.617867 0.382133 0.500000 N\n0.117867 0.117867 0.000000 N\n0.882133 0.882133 0.000000 N\n",
            "nsites": 46,
            "nelements": 3,
            "elements": [
                "Ba",
                "Si",
                "N"
            ],
            "chemical_system": "Ba-N-Si",
            "density": 4.749358474674936,
            "density_atomic": 0.03854092639732213,
            "volume": 1193.536437754027,
            "volume_molar": 15.625313979008105,
            "formula_full": "Ba22 Si4 N20",
            "formula_reduced": "Ba11(SiN5)2",
            "formula_anonymous": "A2B10C11",
            "energy": -254.67340545,
            "energy_per_atom": -5.536378379347826,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -247.45340545,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.5599975,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:34.405000Z",
            "spacegroup": 136
        },
        {
            "id": "mp-759834",
            "created_at": "2022-09-04T14:39:10.342545Z",
            "structure_string": "Li10 V6 P16 O58\n1.0\n9.787663 0.000000 0.000000\n4.861149 8.533888 0.000000\n0.135013 0.054948 14.071254\nLi V P O\n10 6 16 58\ndirect\n0.691284 0.083450 0.441077 Li\n0.228372 0.678384 0.438816 Li\n0.095317 0.678142 0.942962 Li\n0.225283 0.089597 0.940264 Li\n0.092164 0.228052 0.440117 Li\n0.777644 0.917147 0.061041 Li\n0.917699 0.304329 0.057793 Li\n0.661830 0.663482 0.888242 Li\n0.768058 0.321905 0.562223 Li\n0.318229 0.908145 0.558099 Li\n0.999720 0.572606 0.743630 V\n0.000321 0.435767 0.250508 V\n0.567386 0.002235 0.250988 V\n0.432148 0.999369 0.747652 V\n0.564261 0.430248 0.756723 V\n0.436851 0.566970 0.244714 V\n0.683991 0.231075 0.160896 P\n0.684127 0.086979 0.659032 P\n0.237402 0.679777 0.656587 P\n0.323186 0.336195 0.871553 P\n0.332590 0.334596 0.370127 P\n0.089291 0.682371 0.157468 P\n0.913829 0.769912 0.340745 P\n0.230801 0.092362 0.158312 P\n0.770362 0.906581 0.841392 P\n0.086146 0.232960 0.658984 P\n0.909766 0.322396 0.842043 P\n0.666506 0.662588 0.628687 P\n0.672308 0.666284 0.127890 P\n0.765471 0.321311 0.343237 P\n0.318265 0.912197 0.339441 P\n0.316615 0.771145 0.839866 P\n0.760654 0.242643 0.434503 O\n0.665332 0.251818 0.663788 O\n0.766860 0.983972 0.931880 O\n0.666241 0.081319 0.163332 O\n0.520478 0.376053 0.176159 O\n0.471930 0.340105 0.828081 O\n0.383599 0.520999 0.672851 O\n0.227577 0.763472 0.922991 O\n0.253699 0.659895 0.160659 O\n0.486156 0.186372 0.333047 O\n0.522425 0.095373 0.681485 O\n0.329933 0.485765 0.330962 O\n0.311301 0.352587 0.976624 O\n0.319260 0.332642 0.475878 O\n0.177051 0.485590 0.824943 O\n0.377594 0.105316 0.177264 O\n0.326212 0.185944 0.834247 O\n0.087291 0.661968 0.664895 O\n0.991042 0.794255 0.244180 O\n0.010502 0.755777 0.424408 O\n0.999993 0.750686 0.067452 O\n0.096457 0.521502 0.179340 O\n0.182267 0.330834 0.327015 O\n0.922021 0.740029 0.835510 O\n0.096837 0.383114 0.677078 O\n0.250374 0.084821 0.658300 O\n0.789731 0.996115 0.750378 O\n0.752455 0.005760 0.568150 O\n0.243449 0.002526 0.429188 O\n0.747647 0.914909 0.341883 O\n0.903139 0.617966 0.322220 O\n0.079376 0.259076 0.166206 O\n0.815628 0.663695 0.674742 O\n0.894486 0.486466 0.823930 O\n0.003942 0.245494 0.929179 O\n0.997233 0.246489 0.569693 O\n0.998498 0.213645 0.750488 O\n0.915651 0.339010 0.339494 O\n0.675190 0.813922 0.163337 O\n0.627569 0.881861 0.824238 O\n0.820467 0.513828 0.170505 O\n0.681970 0.653525 0.021470 O\n0.677045 0.656353 0.523187 O\n0.668921 0.513128 0.671945 O\n0.480109 0.901955 0.320835 O\n0.513931 0.813279 0.665144 O\n0.745019 0.343145 0.842555 O\n0.787009 0.207340 0.256379 O\n0.772264 0.235811 0.076132 O\n0.617661 0.479759 0.326830 O\n0.524083 0.664951 0.170393 O\n0.485384 0.628579 0.827715 O\n0.335572 0.920378 0.838735 O\n0.228027 0.018862 0.067251 O\n0.209786 0.001224 0.249183 O\n0.335004 0.748812 0.339772 O\n0.240233 0.758538 0.565600 O\n0.218755 0.793553 0.743196 O\n",
            "nsites": 90,
            "nelements": 4,
            "elements": [
                "Li",
                "V",
                "P",
                "O"
            ],
            "chemical_system": "Li-O-P-V",
            "density": 2.5411248192053653,
            "density_atomic": 0.07657442782306621,
            "volume": 1175.3270975521368,
            "volume_molar": 7.8644280227791326,
            "formula_full": "Li10 V6 P16 O58",
            "formula_reduced": "Li5V3P8O29",
            "formula_anonymous": "A3B5C8D29",
            "energy": -682.75329618,
            "energy_per_atom": -7.586147735333333,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -632.70729618,
            "band_gap": 1.2467,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 4.00396,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:42.306000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-1096491",
            "created_at": "2022-09-04T14:39:10.349397Z",
            "structure_string": "Y1 Pd2 Au1\n1.0\n-5.033101 5.936552 8.385171\n5.033101 -5.936552 8.385171\n5.033101 5.936552 -8.385171\nY Pd Au\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.000000 0.237633 0.237633 Pd\n0.000000 0.762367 0.762367 Pd\n0.000000 0.500000 0.500000 Au\n",
            "nsites": 4,
            "nelements": 3,
            "elements": [
                "Y",
                "Pd",
                "Au"
            ],
            "chemical_system": "Au-Pd-Y",
            "density": 0.8263374656901126,
            "density_atomic": 0.00399133476190192,
            "volume": 1002.1710126098145,
            "volume_molar": 150.88037258820094,
            "formula_full": "Y1 Pd2 Au1",
            "formula_reduced": "YPd2Au",
            "formula_anonymous": "ABC2",
            "energy": -14.9424517,
            "energy_per_atom": -3.735612925,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -14.9424517,
            "band_gap": 0.4160000000000003,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 4.09e-05,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:34.245000Z",
            "spacegroup": 71
        },
        {
            "id": "mp-1025229",
            "created_at": "2022-09-04T14:39:10.349930Z",
            "structure_string": "Ti1 Ga5 Co1\n1.0\n4.082653 0.000000 0.000000\n0.000000 4.082653 0.000000\n0.000000 0.000000 6.536703\nTi Ga Co\n1 5 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.000000 0.500000 0.297509 Ga\n0.000000 0.500000 0.702491 Ga\n0.500000 0.000000 0.297509 Ga\n0.500000 0.000000 0.702491 Ga\n0.500000 0.500000 0.000000 Ga\n0.000000 0.000000 0.500000 Co\n",
            "nsites": 7,
            "nelements": 3,
            "elements": [
                "Ti",
                "Ga",
                "Co"
            ],
            "chemical_system": "Co-Ga-Ti",
            "density": 6.940854221434791,
            "density_atomic": 0.06424722124477139,
            "volume": 108.95412851135066,
            "volume_molar": 9.373387118264043,
            "formula_full": "Ti1 Ga5 Co1",
            "formula_reduced": "TiGa5Co",
            "formula_anonymous": "ABC5",
            "energy": -32.47420101,
            "energy_per_atom": -4.639171572857143,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -32.47420101,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 8.22e-05,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:27.774000Z",
            "spacegroup": 123
        },
        {
            "id": "mp-1210362",
            "created_at": "2022-09-04T14:39:10.352877Z",
            "structure_string": "P8 O32\n1.0\n7.625566 0.000000 0.000000\n0.000000 10.101028 0.000000\n0.000000 0.000000 11.122544\nP O\n8 32\ndirect\n0.524901 0.170860 0.737742 P\n0.475099 0.829140 0.262258 P\n0.975099 0.170860 0.762258 P\n0.475099 0.329140 0.237742 P\n0.024901 0.829140 0.237742 P\n0.524901 0.670860 0.762258 P\n0.024901 0.329140 0.262258 P\n0.975099 0.670860 0.737742 P\n0.512039 0.044345 0.806893 O\n0.487961 0.955655 0.193107 O\n0.987961 0.044345 0.693107 O\n0.487961 0.455655 0.306893 O\n0.012039 0.955655 0.306893 O\n0.512039 0.544345 0.693107 O\n0.012039 0.455655 0.193107 O\n0.987961 0.544345 0.806893 O\n0.517058 0.297847 0.806337 O\n0.482942 0.702153 0.193663 O\n0.982942 0.297847 0.693663 O\n0.482942 0.202153 0.306337 O\n0.017058 0.702153 0.306337 O\n0.517058 0.797847 0.693663 O\n0.017058 0.202153 0.193663 O\n0.982942 0.797847 0.806337 O\n0.549113 0.170044 0.604557 O\n0.450887 0.829956 0.395443 O\n0.950887 0.170044 0.895443 O\n0.450887 0.329956 0.104557 O\n0.049113 0.829956 0.104557 O\n0.549113 0.670044 0.895443 O\n0.049113 0.329956 0.395443 O\n0.950887 0.670044 0.604557 O\n0.753749 0.407600 0.020979 O\n0.246251 0.592400 0.979021 O\n0.746251 0.407600 0.479021 O\n0.246251 0.092400 0.520979 O\n0.253749 0.592400 0.520979 O\n0.753749 0.907600 0.479021 O\n0.253749 0.092400 0.979021 O\n0.746251 0.907600 0.020979 O\n",
            "nsites": 40,
            "nelements": 2,
            "elements": [
                "P",
                "O"
            ],
            "chemical_system": "O-P",
            "density": 1.472617506505421,
            "density_atomic": 0.04668938997042371,
            "volume": 856.7256934678043,
            "volume_molar": 12.898306796929324,
            "formula_full": "P8 O32",
            "formula_reduced": "PO4",
            "formula_anonymous": "AB4",
            "energy": -236.94657985,
            "energy_per_atom": -5.92366449625,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -214.96257985,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 23.9907261,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:25.763000Z",
            "spacegroup": 56
        },
        {
            "id": "mp-1223011",
            "created_at": "2022-09-04T14:39:10.367637Z",
            "structure_string": "Mn1 Ag2 Sn3 S8\n1.0\n-3.785083 2.769880 -5.833365\n3.828295 -4.722021 -7.189819\n-3.796238 -4.725092 -7.157717\nMn Ag Sn S\n1 2 3 8\ndirect\n0.500000 0.000000 0.500000 Mn\n0.000000 0.000000 0.500000 Ag\n0.000000 0.500000 0.000000 Ag\n0.567609 0.318048 0.750450 Sn\n0.432391 0.681952 0.249550 Sn\n0.000000 0.000000 0.000000 Sn\n0.452038 0.192025 0.211035 S\n0.820573 0.596412 0.243016 S\n0.546458 0.334124 0.269472 S\n0.184350 0.941154 0.219223 S\n0.547962 0.807975 0.788965 S\n0.179427 0.403588 0.756984 S\n0.453542 0.665876 0.730528 S\n0.815650 0.058846 0.780777 S\n",
            "nsites": 14,
            "nelements": 4,
            "elements": [
                "Mn",
                "Ag",
                "Sn",
                "S"
            ],
            "chemical_system": "Ag-Mn-S-Sn",
            "density": 4.049151496115164,
            "density_atomic": 0.03864761649071724,
            "volume": 362.2474364845412,
            "volume_molar": 15.58217894613619,
            "formula_full": "Mn1 Ag2 Sn3 S8",
            "formula_reduced": "MnAg2Sn3S8",
            "formula_anonymous": "AB2C3D8",
            "energy": -65.13827775,
            "energy_per_atom": -4.652734125,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -61.11427775000001,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 3.1335458,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:25.978000Z",
            "spacegroup": 12
        },
        {
            "id": "mp-769953",
            "created_at": "2022-09-04T14:39:10.376253Z",
            "structure_string": "Tb8 Ti8 O28\n1.0\n7.013420 0.000000 0.000000\n0.000000 7.013420 0.000000\n0.000000 0.000000 12.731974\nTb Ti O\n8 8 28\ndirect\n0.630172 0.140002 0.135675 Tb\n0.640002 0.869828 0.885675 Tb\n0.859998 0.369828 0.364325 Tb\n0.869828 0.640002 0.114325 Tb\n0.130172 0.359998 0.614325 Tb\n0.140002 0.630172 0.864325 Tb\n0.359998 0.130172 0.385675 Tb\n0.369828 0.859998 0.635675 Tb\n0.600258 0.351838 0.612945 Ti\n0.648162 0.399742 0.887055 Ti\n0.851838 0.899742 0.362945 Ti\n0.899742 0.851838 0.637055 Ti\n0.100258 0.148162 0.137055 Ti\n0.148162 0.100258 0.862945 Ti\n0.351838 0.600258 0.387055 Ti\n0.399742 0.648162 0.112945 Ti\n0.542482 0.425255 0.387299 O\n0.573620 0.833948 0.071151 O\n0.574745 0.457518 0.112701 O\n0.637142 0.169957 0.956942 O\n0.666052 0.073620 0.321151 O\n0.669957 0.862858 0.706942 O\n0.678188 0.321812 0.750000 O\n0.821812 0.821812 0.500000 O\n0.830043 0.362858 0.543058 O\n0.833948 0.573620 0.928849 O\n0.862858 0.669957 0.293058 O\n0.925255 0.957518 0.137299 O\n0.926380 0.333948 0.178849 O\n0.957518 0.925255 0.862701 O\n0.042482 0.074745 0.362701 O\n0.073620 0.666052 0.678849 O\n0.074745 0.042482 0.637299 O\n0.137142 0.330043 0.793058 O\n0.166052 0.426380 0.428849 O\n0.169957 0.637142 0.043058 O\n0.178188 0.178188 0.000000 O\n0.321812 0.678188 0.250000 O\n0.330043 0.137142 0.206942 O\n0.333948 0.926380 0.821151 O\n0.362858 0.830043 0.456942 O\n0.425255 0.542482 0.612701 O\n0.426380 0.166052 0.571151 O\n0.457518 0.574745 0.887299 O\n",
            "nsites": 44,
            "nelements": 3,
            "elements": [
                "Tb",
                "Ti",
                "O"
            ],
            "chemical_system": "O-Tb-Ti",
            "density": 5.574332812603089,
            "density_atomic": 0.07025823548895309,
            "volume": 626.2611022578022,
            "volume_molar": 8.571437523430088,
            "formula_full": "Tb8 Ti8 O28",
            "formula_reduced": "Tb2Ti2O7",
            "formula_anonymous": "A2B2C7",
            "energy": -404.53709384,
            "energy_per_atom": -9.19402486,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -385.30109384,
            "band_gap": 3.8992,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0004298,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:35.700000Z",
            "spacegroup": 92
        },
        {
            "id": "mp-1185010",
            "created_at": "2022-09-04T14:39:10.382796Z",
            "structure_string": "Li2 Ca1 Tl1\n1.0\n0.000000 3.551989 3.551989\n3.551989 0.000000 3.551989\n3.551989 3.551989 0.000000\nLi Ca Tl\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.750000 0.750000 0.750000 Li\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Tl\n",
            "nsites": 4,
            "nelements": 3,
            "elements": [
                "Li",
                "Ca",
                "Tl"
            ],
            "chemical_system": "Ca-Li-Tl",
            "density": 4.786317103455471,
            "density_atomic": 0.04462879483070046,
            "volume": 89.62823251611474,
            "volume_molar": 13.493845807051299,
            "formula_full": "Li2 Ca1 Tl1",
            "formula_reduced": "Li2CaTl",
            "formula_anonymous": "ABC2",
            "energy": -9.17980658,
            "energy_per_atom": -2.294951645,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -9.17980658,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0011184,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:43.926000Z",
            "spacegroup": 225
        },
        {
            "id": "mp-755399",
            "created_at": "2022-09-04T14:39:10.391580Z",
            "structure_string": "Li2 Cu1 Sn1 O4\n1.0\n3.017079 0.000000 0.000000\n0.000000 5.417841 0.000000\n0.000000 2.266400 5.056754\nLi Cu Sn O\n2 1 1 4\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.500000 Li\n0.000000 0.500000 0.500000 Cu\n0.500000 0.500000 0.000000 Sn\n0.000000 0.235847 0.221005 O\n0.500000 0.297470 0.745751 O\n0.000000 0.764153 0.778995 O\n0.500000 0.702530 0.254249 O\n",
            "nsites": 8,
            "nelements": 4,
            "elements": [
                "Li",
                "Cu",
                "Sn",
                "O"
            ],
            "chemical_system": "Cu-Li-O-Sn",
            "density": 5.225936442422319,
            "density_atomic": 0.09678436898281254,
            "volume": 82.65797549830263,
            "volume_molar": 6.2222245423426195,
            "formula_full": "Li2 Cu1 Sn1 O4",
            "formula_reduced": "Li2CuSnO4",
            "formula_anonymous": "ABC2D4",
            "energy": -46.44922813,
            "energy_per_atom": -5.80615351625,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -43.70122813,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 0.9975781,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:35.757000Z",
            "spacegroup": 10
        }
    ]
}