GET /third-parties/MatprojStructure/?format=api&ordering=chemical_system&page=12137
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=chemical_system&page=12138",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=chemical_system&page=12136",
    "results": [
        {
            "id": "mp-1215700",
            "created_at": "2022-09-04T14:39:13.117720Z",
            "structure_string": "Y1 Zr1 S2\n1.0\n6.196663 -1.928241 0.000000\n6.196663 1.928241 0.000000\n5.596645 0.000000 3.285471\nY Zr S\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Zr\n0.246575 0.246575 0.246575 S\n0.753425 0.753425 0.753425 S\n",
            "nsites": 4,
            "nelements": 3,
            "elements": [
                "Y",
                "Zr",
                "S"
            ],
            "chemical_system": "S-Y-Zr",
            "density": 5.165999486486488,
            "density_atomic": 0.050946360745673804,
            "volume": 78.51394960217382,
            "volume_molar": 11.82055140319592,
            "formula_full": "Y1 Zr1 S2",
            "formula_reduced": "YZrS2",
            "formula_anonymous": "ABC2",
            "energy": -30.92048285,
            "energy_per_atom": -7.7301207125,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -29.91448285,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0002439,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:29.049000Z",
            "spacegroup": 166
        },
        {
            "id": "mp-556775",
            "created_at": "2022-09-04T14:39:10.801513Z",
            "structure_string": "Zn16 S16\n1.0\n1.925864 -3.335694 0.000000\n1.925864 3.335694 0.000000\n0.000000 0.000000 50.410769\nZn S\n16 16\ndirect\n0.333333 0.666667 0.562518 Zn\n0.666667 0.333333 0.125010 Zn\n0.000000 0.000000 0.375009 Zn\n0.333333 0.666667 0.062523 Zn\n0.666667 0.333333 0.500009 Zn\n0.333333 0.666667 0.312503 Zn\n0.666667 0.333333 0.250026 Zn\n0.000000 0.000000 0.812505 Zn\n0.666667 0.333333 0.750007 Zn\n0.000000 0.000000 0.187513 Zn\n0.333333 0.666667 0.437526 Zn\n0.333333 0.666667 0.937513 Zn\n0.000000 0.000000 0.625010 Zn\n0.666667 0.333333 0.875027 Zn\n0.333333 0.666667 0.687531 Zn\n0.000000 0.000000 0.000009 Zn\n0.000000 0.000000 0.234387 S\n0.333333 0.666667 0.359319 S\n0.666667 0.333333 0.296849 S\n0.666667 0.333333 0.546895 S\n0.333333 0.666667 0.109355 S\n0.666667 0.333333 0.796815 S\n0.333333 0.666667 0.984321 S\n0.666667 0.333333 0.921854 S\n0.000000 0.000000 0.859396 S\n0.333333 0.666667 0.609319 S\n0.000000 0.000000 0.421893 S\n0.333333 0.666667 0.734348 S\n0.000000 0.000000 0.671894 S\n0.000000 0.000000 0.046896 S\n0.666667 0.333333 0.171823 S\n0.333333 0.666667 0.484319 S\n",
            "nsites": 32,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.9984597771338435,
            "density_atomic": 0.04940658557034598,
            "volume": 647.6869354681032,
            "volume_molar": 12.188943418131108,
            "formula_full": "Zn16 S16",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -120.31549985,
            "energy_per_atom": -3.7598593703125,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -112.26749985,
            "band_gap": 2.0399000000000003,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 2.79e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:37.195000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-560588",
            "created_at": "2022-09-04T14:39:14.886141Z",
            "structure_string": "Zn2 S2\n1.0\n1.924139 -3.332706 0.000000\n1.924139 3.332706 0.000000\n0.000000 0.000000 6.317452\nZn S\n2 2\ndirect\n0.333333 0.666667 0.500051 Zn\n0.666667 0.333333 0.000051 Zn\n0.333333 0.666667 0.125949 S\n0.666667 0.333333 0.625949 S\n",
            "nsites": 4,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.995420460900116,
            "density_atomic": 0.04936903055017653,
            "volume": 81.02245386274244,
            "volume_molar": 12.198215547051015,
            "formula_full": "Zn2 S2",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -15.0317524,
            "energy_per_atom": -3.7579381,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -14.0257524,
            "band_gap": 2.0791000000000004,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:39.866000Z",
            "spacegroup": 186
        },
        {
            "id": "mp-13456",
            "created_at": "2022-09-04T14:48:26.619098Z",
            "structure_string": "Zn5 S5\n1.0\n15.793380 -1.926423 0.000000\n15.793380 1.926423 0.000000\n15.558401 0.000000 3.328378\nZn S\n5 5\ndirect\n0.733321 0.733321 0.733321 Zn\n0.133316 0.133316 0.133316 Zn\n0.533327 0.533327 0.533327 Zn\n0.266680 0.266680 0.266680 Zn\n0.999957 0.999957 0.999957 Zn\n0.683288 0.683288 0.683288 S\n0.083393 0.083393 0.083393 S\n0.483299 0.483299 0.483299 S\n0.216735 0.216735 0.216735 S\n0.950011 0.950011 0.950011 S\n",
            "nsites": 10,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.995935892166152,
            "density_atomic": 0.049375399427286824,
            "volume": 202.53000716939212,
            "volume_molar": 12.196642112978886,
            "formula_full": "Zn5 S5",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -37.48806338,
            "energy_per_atom": -3.748806338,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -34.97306338,
            "band_gap": 2.0416,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0051471,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:39:31.335000Z",
            "spacegroup": 160
        },
        {
            "id": "mp-554681",
            "created_at": "2022-09-04T14:48:20.698496Z",
            "structure_string": "Zn28 S28\n1.0\n1.926569 -3.336915 0.000000\n1.926569 3.336915 0.000000\n0.000000 0.000000 88.144620\nZn S\n28 28\ndirect\n0.000000 0.000000 0.071430 Zn\n0.333333 0.666667 0.321430 Zn\n0.333333 0.666667 0.214291 Zn\n0.666667 0.333333 0.142861 Zn\n0.666667 0.333333 0.357143 Zn\n0.000000 0.000000 0.392860 Zn\n0.666667 0.333333 0.464291 Zn\n0.333333 0.666667 0.642860 Zn\n0.000000 0.000000 0.785719 Zn\n0.666667 0.333333 0.571431 Zn\n0.333333 0.666667 0.535714 Zn\n0.666667 0.333333 0.892865 Zn\n0.666667 0.333333 0.821430 Zn\n0.666667 0.333333 0.964295 Zn\n0.000000 0.000000 0.285714 Zn\n0.000000 0.000000 0.607143 Zn\n0.666667 0.333333 0.678573 Zn\n0.000000 0.000000 0.714291 Zn\n0.333333 0.666667 0.107143 Zn\n0.000000 0.000000 0.928570 Zn\n0.666667 0.333333 0.035718 Zn\n0.000000 0.000000 0.178573 Zn\n0.333333 0.666667 0.000000 Zn\n0.000000 0.000000 0.500003 Zn\n0.333333 0.666667 0.857140 Zn\n0.333333 0.666667 0.428573 Zn\n0.666667 0.333333 0.250003 Zn\n0.333333 0.666667 0.750000 Zn\n0.000000 0.000000 0.205357 S\n0.666667 0.333333 0.848194 S\n0.333333 0.666667 0.776800 S\n0.666667 0.333333 0.991054 S\n0.666667 0.333333 0.705357 S\n0.333333 0.666667 0.455357 S\n0.000000 0.000000 0.633927 S\n0.333333 0.666667 0.026800 S\n0.333333 0.666667 0.348210 S\n0.333333 0.666667 0.883941 S\n0.000000 0.000000 0.419640 S\n0.000000 0.000000 0.098208 S\n0.333333 0.666667 0.133927 S\n0.000000 0.000000 0.312497 S\n0.000000 0.000000 0.526787 S\n0.666667 0.333333 0.169640 S\n0.333333 0.666667 0.669640 S\n0.666667 0.333333 0.598208 S\n0.333333 0.666667 0.241070 S\n0.000000 0.000000 0.741056 S\n0.000000 0.000000 0.812496 S\n0.666667 0.333333 0.919625 S\n0.000000 0.000000 0.955371 S\n0.666667 0.333333 0.383927 S\n0.666667 0.333333 0.276787 S\n0.666667 0.333333 0.062496 S\n0.666667 0.333333 0.491070 S\n0.333333 0.666667 0.562497 S\n",
            "nsites": 56,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.9988986717818142,
            "density_atomic": 0.04941200873005997,
            "volume": 1133.3277362984882,
            "volume_molar": 12.187605634288673,
            "formula_full": "Zn28 S28",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -210.58586554,
            "energy_per_atom": -3.760461884642857,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -196.50186554,
            "band_gap": 2.0164,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 1.44e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:39:32.107000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-555214",
            "created_at": "2022-09-04T14:48:29.510168Z",
            "structure_string": "Zn26 S26\n1.0\n1.924387 -3.333137 0.000000\n1.924387 3.333137 0.000000\n0.000000 0.000000 81.845997\nZn S\n26 26\ndirect\n0.000000 0.000000 0.692292 Zn\n0.333333 0.666667 0.115374 Zn\n0.333333 0.666667 0.307700 Zn\n0.333333 0.666667 0.923046 Zn\n0.000000 0.000000 0.961522 Zn\n0.666667 0.333333 0.884604 Zn\n0.666667 0.333333 0.384601 Zn\n0.666667 0.333333 0.269217 Zn\n0.000000 0.000000 0.461522 Zn\n0.333333 0.666667 0.807756 Zn\n0.333333 0.666667 0.730938 Zn\n0.000000 0.000000 0.076912 Zn\n0.000000 0.000000 0.346147 Zn\n0.000000 0.000000 0.846153 Zn\n0.333333 0.666667 0.653813 Zn\n0.333333 0.666667 0.000015 Zn\n0.666667 0.333333 0.615392 Zn\n0.666667 0.333333 0.153832 Zn\n0.666667 0.333333 0.038455 Zn\n0.000000 0.000000 0.576908 Zn\n0.666667 0.333333 0.538435 Zn\n0.333333 0.666667 0.230739 Zn\n0.333333 0.666667 0.500012 Zn\n0.000000 0.000000 0.192292 Zn\n0.333333 0.666667 0.423046 Zn\n0.000000 0.000000 0.769751 Zn\n0.333333 0.666667 0.028874 S\n0.333333 0.666667 0.759995 S\n0.333333 0.666667 0.451898 S\n0.666667 0.333333 0.644242 S\n0.666667 0.333333 0.796897 S\n0.000000 0.000000 0.221156 S\n0.000000 0.000000 0.721219 S\n0.666667 0.333333 0.067319 S\n0.000000 0.000000 0.105782 S\n0.000000 0.000000 0.375015 S\n0.333333 0.666667 0.682668 S\n0.000000 0.000000 0.990428 S\n0.666667 0.333333 0.298114 S\n0.333333 0.666667 0.144243 S\n0.666667 0.333333 0.182700 S\n0.000000 0.000000 0.875026 S\n0.333333 0.666667 0.336557 S\n0.333333 0.666667 0.836589 S\n0.666667 0.333333 0.413464 S\n0.333333 0.666667 0.528866 S\n0.333333 0.666667 0.951899 S\n0.666667 0.333333 0.567281 S\n0.666667 0.333333 0.913466 S\n0.000000 0.000000 0.490428 S\n0.333333 0.666667 0.259591 S\n0.000000 0.000000 0.605811 S\n",
            "nsites": 52,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 4.008096930154903,
            "density_atomic": 0.04952566612934333,
            "volume": 1049.960637867941,
            "volume_molar": 12.159636064807936,
            "formula_full": "Zn26 S26",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -194.85409909,
            "energy_per_atom": -3.747194213269231,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -181.77609909,
            "band_gap": 1.5972999999999995,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0189554,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:39:47.104000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-554986",
            "created_at": "2022-09-04T14:48:20.836312Z",
            "structure_string": "Zn34 S34\n1.0\n1.926602 -3.336973 0.000000\n1.926602 3.336973 0.000000\n0.000000 0.000000 107.072302\nZn S\n34 34\ndirect\n0.000000 0.000000 0.382347 Zn\n0.333333 0.666667 0.323546 Zn\n0.000000 0.000000 0.941604 Zn\n0.666667 0.333333 0.470592 Zn\n0.666667 0.333333 0.205915 Zn\n0.666667 0.333333 0.294116 Zn\n0.666667 0.333333 0.352975 Zn\n0.666667 0.333333 0.647048 Zn\n0.666667 0.333333 0.970943 Zn\n0.666667 0.333333 0.764722 Zn\n0.333333 0.666667 0.411771 Zn\n0.000000 0.000000 0.088221 Zn\n0.000000 0.000000 0.882507 Zn\n0.000000 0.000000 0.735324 Zn\n0.000000 0.000000 0.264713 Zn\n0.000000 0.000000 0.441197 Zn\n0.666667 0.333333 0.058828 Zn\n0.333333 0.666667 0.705886 Zn\n0.333333 0.666667 0.029472 Zn\n0.000000 0.000000 0.529383 Zn\n0.000000 0.000000 0.000201 Zn\n0.000000 0.000000 0.176474 Zn\n0.333333 0.666667 0.617644 Zn\n0.666667 0.333333 0.852997 Zn\n0.000000 0.000000 0.823533 Zn\n0.000000 0.000000 0.676451 Zn\n0.333333 0.666667 0.912075 Zn\n0.333333 0.666667 0.794131 Zn\n0.666667 0.333333 0.147031 Zn\n0.333333 0.666667 0.117630 Zn\n0.000000 0.000000 0.588247 Zn\n0.666667 0.333333 0.558813 Zn\n0.333333 0.666667 0.235308 Zn\n0.333333 0.666667 0.499991 Zn\n0.000000 0.000000 0.286763 S\n0.666667 0.333333 0.316161 S\n0.000000 0.000000 0.022185 S\n0.333333 0.666667 0.051493 S\n0.666667 0.333333 0.080872 S\n0.000000 0.000000 0.610290 S\n0.333333 0.666667 0.522036 S\n0.000000 0.000000 0.845586 S\n0.000000 0.000000 0.198560 S\n0.000000 0.000000 0.963622 S\n0.333333 0.666667 0.139684 S\n0.333333 0.666667 0.727969 S\n0.333333 0.666667 0.639697 S\n0.333333 0.666667 0.816181 S\n0.333333 0.666667 0.934210 S\n0.666667 0.333333 0.786774 S\n0.333333 0.666667 0.257357 S\n0.333333 0.666667 0.433843 S\n0.000000 0.000000 0.110273 S\n0.000000 0.000000 0.757365 S\n0.000000 0.000000 0.404384 S\n0.000000 0.000000 0.551424 S\n0.666667 0.333333 0.492638 S\n0.666667 0.333333 0.992953 S\n0.666667 0.333333 0.875100 S\n0.666667 0.333333 0.580895 S\n0.666667 0.333333 0.169078 S\n0.666667 0.333333 0.669099 S\n0.000000 0.000000 0.698496 S\n0.000000 0.000000 0.463234 S\n0.333333 0.666667 0.345623 S\n0.666667 0.333333 0.375005 S\n0.000000 0.000000 0.904600 S\n0.666667 0.333333 0.227956 S\n",
            "nsites": 68,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.997283655978585,
            "density_atomic": 0.04939205294184971,
            "volume": 1376.7396969722602,
            "volume_molar": 12.192529772127495,
            "formula_full": "Zn34 S34",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -255.69569403,
            "energy_per_atom": -3.7602307945588236,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -238.59369403,
            "band_gap": 2.0291,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0110307,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:39:07.875000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-581258",
            "created_at": "2022-09-04T14:39:29.751121Z",
            "structure_string": "Zn12 S12\n1.0\n3.850251 -0.001774 37.641939\n1.918587 3.338182 37.641939\n-0.003068 -0.001774 37.838341\nZn S\n12 12\ndirect\n0.083339 0.083339 0.083339 Zn\n0.611125 0.611125 0.611125 Zn\n0.500011 0.500011 0.500011 Zn\n0.194454 0.194454 0.194454 Zn\n0.916671 0.916671 0.916671 Zn\n0.361127 0.361127 0.361127 Zn\n0.000002 0.000002 0.000002 Zn\n0.805550 0.805550 0.805550 Zn\n0.722221 0.722221 0.722221 Zn\n0.555563 0.555563 0.555563 Zn\n0.305554 0.305554 0.305554 Zn\n0.444453 0.444453 0.444453 Zn\n0.937511 0.937511 0.937511 S\n0.104164 0.104164 0.104164 S\n0.520816 0.520816 0.520816 S\n0.381939 0.381939 0.381939 S\n0.215291 0.215291 0.215291 S\n0.465255 0.465255 0.465255 S\n0.743048 0.743048 0.743048 S\n0.020844 0.020844 0.020844 S\n0.826392 0.826392 0.826392 S\n0.576368 0.576368 0.576368 S\n0.631939 0.631939 0.631939 S\n0.326366 0.326366 0.326366 S\n",
            "nsites": 24,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.988537969528025,
            "density_atomic": 0.04928398770421444,
            "volume": 486.9735814406852,
            "volume_molar": 12.219264390988043,
            "formula_full": "Zn12 S12",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -89.98438188,
            "energy_per_atom": -3.749349245,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -83.94838188,
            "band_gap": 2.03,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 9.43e-05,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:37.391000Z",
            "spacegroup": 160
        },
        {
            "id": "mp-1245062",
            "created_at": "2022-09-04T14:39:20.820060Z",
            "structure_string": "Zn50 S50\n1.0\n13.267458 0.209941 -0.305277\n0.205095 13.266326 0.145047\n-0.302705 0.152314 13.489062\nZn S\n50 50\ndirect\n0.512142 0.858684 0.339616 Zn\n0.259316 0.607328 0.352269 Zn\n0.205504 0.735883 0.640932 Zn\n0.037370 0.173752 0.411628 Zn\n0.429459 0.518688 0.733078 Zn\n0.413700 0.155018 0.715199 Zn\n0.628075 0.055657 0.329922 Zn\n0.555871 0.683860 0.700337 Zn\n0.209471 0.623578 0.860174 Zn\n0.558178 0.479849 0.490522 Zn\n0.708727 0.683167 0.188075 Zn\n0.708708 0.732662 0.359043 Zn\n0.381145 0.765910 0.125952 Zn\n0.747281 0.119693 0.813748 Zn\n0.019498 0.221429 0.015139 Zn\n0.956546 0.881463 0.477134 Zn\n0.162786 0.277305 0.665865 Zn\n0.765899 0.280986 0.254636 Zn\n0.839268 0.336894 0.986322 Zn\n0.507224 0.086336 0.561877 Zn\n0.774834 0.910573 0.669793 Zn\n0.303982 0.550244 0.545939 Zn\n0.521767 0.647780 0.944297 Zn\n0.378044 0.849247 0.815384 Zn\n0.875405 0.320984 0.742718 Zn\n0.566744 0.246954 0.651118 Zn\n0.498969 0.284150 0.341615 Zn\n0.855503 0.149528 0.041611 Zn\n0.921904 0.621990 0.496324 Zn\n0.161289 0.731467 0.462578 Zn\n0.268258 0.121375 0.482356 Zn\n0.268621 0.821768 0.987170 Zn\n0.972195 0.084968 0.662935 Zn\n0.249554 0.282123 0.204417 Zn\n0.454106 0.538641 0.185200 Zn\n0.141216 0.520857 0.125517 Zn\n0.410837 0.209715 0.022418 Zn\n0.227964 0.788640 0.290484 Zn\n0.948669 0.882003 0.899222 Zn\n0.801334 0.546373 0.740777 Zn\n0.239504 0.421295 0.435015 Zn\n0.399862 0.386083 0.974562 Zn\n0.176220 0.006392 0.106589 Zn\n0.955782 0.648889 0.233762 Zn\n0.029715 0.791055 0.037366 Zn\n0.913262 0.606199 0.947390 Zn\n0.972441 0.384364 0.227548 Zn\n0.232244 0.142757 0.871679 Zn\n0.789027 0.343357 0.499983 Zn\n0.953448 0.695645 0.688997 Zn\n0.847996 0.705234 0.815273 S\n0.750555 0.250559 0.647291 S\n0.294066 0.270758 0.778865 S\n0.982152 0.736637 0.384709 S\n0.899839 0.440938 0.861298 S\n0.260443 0.107137 0.221155 S\n0.368583 0.026470 0.852638 S\n0.660458 0.902529 0.406284 S\n0.852066 0.795840 0.576074 S\n0.876678 0.999433 0.775378 S\n0.514423 0.264580 0.166793 S\n0.173533 0.070517 0.342930 S\n0.210565 0.799670 0.810727 S\n0.627534 0.524683 0.766702 S\n0.645965 0.370616 0.389549 S\n0.112487 0.077127 0.961770 S\n0.907111 0.287044 0.373786 S\n0.535989 0.407952 0.108520 S\n0.088184 0.621529 -0.013591 S\n0.813963 0.512418 0.565601 S\n0.169308 0.274625 0.498343 S\n0.718681 0.217322 0.944416 S\n0.449153 0.410541 0.601220 S\n0.022346 0.224318 0.741329 S\n0.179189 0.550688 0.697470 S\n0.649905 0.532276 0.919765 S\n0.839893 0.046343 0.177096 S\n0.483309 0.119455 0.394245 S\n0.107896 0.864493 0.173963 S\n0.703900 0.127997 0.200359 S\n0.628051 0.650738 0.514389 S\n0.858652 0.684809 0.097063 S\n0.344917 0.031727 0.607521 S\n0.373035 0.543932 0.891834 S\n0.288018 0.607128 0.173577 S\n0.369934 0.881132 0.251791 S\n0.448758 0.575267 0.364952 S\n0.496883 0.704446 0.433675 S\n0.064534 0.521058 0.283127 S\n0.028520 0.544571 0.642904 S\n0.536141 0.784583 0.836103 S\n0.603864 0.031728 0.792985 S\n0.023431 0.028744 0.516544 S\n0.539262 0.679672 0.113908 S\n0.419898 0.037996 0.001493 S\n0.344348 0.376456 0.309644 S\n0.817948 0.401685 0.144137 S\n0.611580 0.964207 0.655837 S\n0.386908 0.671999 0.638359 S\n0.111039 0.342558 0.113866 S\n",
            "nsites": 100,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.411736356054916,
            "density_atomic": 0.04215679376915367,
            "volume": 2372.0969044180606,
            "volume_molar": 14.285101454765828,
            "formula_full": "Zn50 S50",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -330.34630042,
            "energy_per_atom": -3.3034630041999997,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -305.19630042,
            "band_gap": 0.712,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:34.043000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-561258",
            "created_at": "2022-09-04T14:39:47.705139Z",
            "structure_string": "Zn10 S10\n1.0\n1.927027 -3.337708 0.000000\n1.927027 3.337708 0.000000\n0.000000 0.000000 31.487513\nZn S\n10 10\ndirect\n0.666667 0.333333 0.199995 Zn\n0.000000 0.000000 0.799986 Zn\n0.666667 0.333333 0.899987 Zn\n0.333333 0.666667 0.699995 Zn\n0.333333 0.666667 0.099995 Zn\n0.666667 0.333333 0.599995 Zn\n0.000000 0.000000 0.000017 Zn\n0.333333 0.666667 0.399987 Zn\n0.000000 0.000000 0.299986 Zn\n0.000000 0.000000 0.500017 Zn\n0.666667 0.333333 0.275004 S\n0.000000 0.000000 0.075001 S\n0.666667 0.333333 0.675005 S\n0.000000 0.000000 0.874946 S\n0.333333 0.666667 0.775004 S\n0.000000 0.000000 0.575001 S\n0.333333 0.666667 0.175005 S\n0.333333 0.666667 0.475063 S\n0.666667 0.333333 0.975063 S\n0.000000 0.000000 0.374946 S\n",
            "nsites": 20,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.996072795065455,
            "density_atomic": 0.04937709105486001,
            "volume": 405.04613724164443,
            "volume_molar": 12.196224263817303,
            "formula_full": "Zn10 S10",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -75.20577679,
            "energy_per_atom": -3.7602888395000003,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -70.17577679,
            "band_gap": 2.0288,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0034418,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:45.496000Z",
            "spacegroup": 186
        },
        {
            "id": "mp-1245070",
            "created_at": "2022-09-04T14:47:55.710721Z",
            "structure_string": "Zn50 S50\n1.0\n13.631315 0.049689 -0.001021\n0.037454 14.017005 -0.022250\n-0.001144 -0.012102 12.744048\nZn S\n50 50\ndirect\n0.450048 0.859077 0.944818 Zn\n0.359847 0.277823 0.174785 Zn\n0.714909 0.192215 0.004560 Zn\n0.553039 0.393694 0.756067 Zn\n0.115616 0.136913 0.178636 Zn\n0.850575 0.375816 0.712753 Zn\n0.524979 0.943684 0.609395 Zn\n0.546488 0.086762 0.220057 Zn\n0.322426 0.120467 0.751964 Zn\n0.669198 0.846754 0.822707 Zn\n0.761621 0.420748 0.498323 Zn\n0.651210 0.912035 0.007217 Zn\n0.739390 0.680065 0.027381 Zn\n0.967287 0.919485 0.018728 Zn\n0.203510 0.568540 0.096320 Zn\n0.695714 0.440246 0.019817 Zn\n0.132222 0.098183 0.511207 Zn\n0.133091 0.724058 0.274964 Zn\n0.932413 0.950629 0.305812 Zn\n0.064191 0.036544 0.761028 Zn\n0.988232 0.224539 0.942726 Zn\n0.680833 0.198835 0.632018 Zn\n0.899021 0.333033 0.195997 Zn\n0.438133 0.217421 0.458915 Zn\n0.340747 0.071382 0.969919 Zn\n0.209165 0.721066 0.720772 Zn\n0.936214 0.814305 0.875049 Zn\n0.524009 0.796575 0.104249 Zn\n0.600138 0.037101 0.865744 Zn\n0.724908 0.949058 0.488529 Zn\n0.291928 0.932303 0.139858 Zn\n0.042502 0.390725 0.450896 Zn\n0.401680 0.757569 0.328009 Zn\n0.258639 0.268556 0.425364 Zn\n0.337167 0.007057 0.360347 Zn\n0.668971 0.803808 0.285816 Zn\n0.606847 0.362429 0.246209 Zn\n0.448878 0.736411 0.648044 Zn\n0.093460 0.274782 0.722173 Zn\n0.496453 0.462120 0.473272 Zn\n0.251401 0.509268 0.342658 Zn\n0.346680 0.529471 0.557795 Zn\n0.364485 0.335446 0.575159 Zn\n0.999993 0.562518 0.319824 Zn\n0.822217 0.025009 0.802493 Zn\n0.062744 0.678606 0.872925 Zn\n0.942148 0.619244 0.993792 Zn\n0.735470 0.565262 0.767172 Zn\n0.314956 0.459286 0.021985 Zn\n0.967652 0.879494 0.601433 Zn\n0.664135 0.031860 0.625068 S\n0.025869 0.990663 0.168459 S\n0.416950 0.052913 0.517653 S\n0.028962 0.269360 0.111509 S\n0.116117 0.272291 0.544199 S\n0.268971 0.157826 0.096422 S\n0.244628 0.361167 0.275493 S\n0.748889 0.819611 0.121017 S\n0.741239 0.304435 0.132392 S\n0.699849 0.409901 0.838813 S\n0.540046 0.298799 0.607987 S\n0.425183 0.497065 0.774539 S\n0.499079 0.232651 0.287268 S\n0.220644 0.641045 0.872412 S\n0.307950 0.688771 0.578735 S\n0.802415 0.046959 0.364969 S\n0.494918 0.850837 0.761727 S\n0.284705 0.644777 0.252308 S\n0.077136 0.830911 0.734741 S\n0.827371 0.870355 0.739907 S\n0.814734 0.544846 0.082760 S\n0.814348 0.276152 0.570336 S\n0.957793 0.063819 0.903671 S\n0.205586 0.117083 0.350991 S\n0.539608 0.701551 0.246105 S\n0.171909 0.156499 0.818915 S\n0.639435 0.467674 0.382262 S\n0.024668 0.705024 0.423368 S\n0.448214 0.352026 0.031611 S\n0.829292 0.527301 0.627698 S\n0.983298 0.350991 0.824891 S\n0.665372 0.681407 0.866955 S\n0.537548 0.801485 0.499257 S\n0.907171 0.424486 0.348973 S\n0.182594 0.884024 0.273870 S\n0.129252 0.530360 0.463635 S\n0.619996 0.070513 0.060559 S\n0.720127 0.156783 0.826617 S\n0.302478 0.431441 0.706644 S\n0.691653 0.786035 0.472905 S\n0.536244 0.456592 0.105304 S\n0.453950 0.130332 0.854728 S\n0.278708 0.852963 0.402210 S\n0.439555 0.957050 0.228143 S\n0.666300 -0.011158 0.311483 S\n0.290414 0.914043 0.963650 S\n0.996790 0.043810 0.595189 S\n0.925451 0.826141 0.427771 S\n0.286859 0.040350 0.603740 S\n0.049468 0.620838 0.152201 S\n",
            "nsites": 100,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.3236279073619173,
            "density_atomic": 0.041068090155148215,
            "volume": 2434.9805316540683,
            "volume_molar": 14.663795509480433,
            "formula_full": "Zn50 S50",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -335.63398116,
            "energy_per_atom": -3.3563398116000003,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -310.48398116,
            "band_gap": 1.3785,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:38:15.493000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-1245121",
            "created_at": "2022-09-04T14:47:55.198011Z",
            "structure_string": "Zn50 S50\n1.0\n12.734203 0.602753 0.866100\n0.589183 13.682042 0.123827\n0.892227 0.119205 13.869363\nZn S\n50 50\ndirect\n0.402224 0.634407 0.782713 Zn\n0.418453 0.276843 0.771649 Zn\n0.549235 0.385106 0.836289 Zn\n0.334509 0.072863 0.599334 Zn\n0.902206 0.810241 0.232522 Zn\n0.837525 0.578507 0.363807 Zn\n0.917730 0.244993 0.887081 Zn\n0.644650 0.696006 0.813668 Zn\n0.068698 0.374558 0.004570 Zn\n0.236734 0.214954 0.788320 Zn\n0.521561 0.280307 0.384588 Zn\n0.914603 0.708343 0.833502 Zn\n0.370294 0.853731 0.766203 Zn\n0.213431 0.078407 0.329195 Zn\n0.079370 0.721336 0.443289 Zn\n0.609721 0.315951 0.078522 Zn\n0.374270 0.360324 0.550634 Zn\n0.745686 0.038389 0.332655 Zn\n0.535209 0.073574 0.049101 Zn\n0.079980 0.995954 0.751871 Zn\n0.351011 0.839525 0.399957 Zn\n0.484424 0.014708 0.349143 Zn\n0.974352 0.201885 0.720958 Zn\n0.606527 0.996229 0.589260 Zn\n0.331525 0.300739 0.367556 Zn\n0.387366 0.935035 0.970945 Zn\n0.073006 0.643502 0.923908 Zn\n0.597812 0.507754 0.605392 Zn\n0.756667 0.261518 0.642104 Zn\n0.706928 0.974365 0.888192 Zn\n0.500637 0.618173 0.240647 Zn\n0.066899 0.457303 0.703375 Zn\n0.563728 0.192954 0.848836 Zn\n0.982329 0.163503 0.131898 Zn\n0.362734 0.946361 0.156145 Zn\n0.840028 0.891189 0.681438 Zn\n0.770313 0.365641 0.238049 Zn\n0.854914 0.501304 0.721508 Zn\n0.125135 0.507481 0.469661 Zn\n0.689248 0.533581 0.005324 Zn\n0.329769 0.630336 0.388438 Zn\n0.953800 0.386826 0.591509 Zn\n0.262805 0.374068 0.876904 Zn\n0.754190 0.795235 0.435842 Zn\n0.258605 0.218737 0.124449 Zn\n0.530273 0.623800 0.407693 Zn\n0.026792 0.320860 0.358628 Zn\n0.219789 0.659180 0.209940 Zn\n0.405158 0.780204 0.056129 Zn\n0.094762 0.788778 0.808391 Zn\n0.561276 0.652342 0.686025 S\n0.898657 0.120888 0.283430 S\n0.473146 0.875876 0.264053 S\n0.000898 0.800051 0.089786 S\n0.232625 0.367288 0.049888 S\n0.186004 0.246060 0.302192 S\n0.633805 0.276785 0.229943 S\n0.388008 0.632709 0.121044 S\n0.409438 0.123640 0.168539 S\n0.067381 0.639571 0.594238 S\n0.446839 0.938091 0.631684 S\n0.670061 0.126137 0.696275 S\n0.522247 0.436302 0.484756 S\n0.270695 0.987168 0.863064 S\n0.261763 0.733544 0.739136 S\n0.769342 0.920956 0.539548 S\n0.170498 0.985513 0.206108 S\n0.868793 0.262911 0.338671 S\n0.523755 0.029532 0.892087 S\n0.929664 0.718924 0.369748 S\n0.919945 0.296450 0.047718 S\n0.760520 0.820184 0.827875 S\n0.802327 0.057846 0.754131 S\n0.821717 0.518802 0.205185 S\n0.552723 0.442878 0.991498 S\n0.154901 0.128994 0.682615 S\n0.593429 0.106548 0.422108 S\n0.959414 0.461030 0.435156 S\n0.699194 0.408480 0.709230 S\n0.690091 0.638287 0.461691 S\n0.698110 0.200930 0.961550 S\n0.789311 0.581121 0.868990 S\n0.739168 0.884431 0.282840 S\n0.386942 0.713378 0.506512 S\n0.199622 0.785456 0.330692 S\n0.149834 0.091679 0.095489 S\n0.697648 0.606558 0.151444 S\n0.190102 0.387915 0.573875 S\n0.923989 0.226062 0.569622 S\n0.088495 0.662635 0.091472 S\n0.236402 0.519402 0.326889 S\n0.118283 0.941528 0.903361 S\n0.309972 0.015341 0.442900 S\n0.722945 0.064253 0.033260 S\n0.906028 0.659528 0.650627 S\n0.426783 0.210947 0.619900 S\n0.098275 0.476386 0.864610 S\n0.023089 0.873524 0.675888 S\n0.392753 0.460855 0.784176 S\n0.469827 0.761002 0.889376 S\n",
            "nsites": 100,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.3708081090215973,
            "density_atomic": 0.0416510678016549,
            "volume": 2400.898831122566,
            "volume_molar": 14.458550711539562,
            "formula_full": "Zn50 S50",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -335.16917706,
            "energy_per_atom": -3.3516917706,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -310.01917706,
            "band_gap": 1.0037999999999998,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:38:19.063000Z",
            "spacegroup": 1
        }
    ]
}