GET /third-parties/MatprojStructure/?format=api&ordering=-chemical_system&page=49
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=50",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-chemical_system&page=48",
    "results": [
        {
            "id": "mp-1199343",
            "created_at": "2022-09-04T14:47:10.208373Z",
            "structure_string": "Zn18 S18\n1.0\n-1.936941 -3.354880 0.000000\n1.936941 -3.354880 0.000000\n0.000000 -2.236586 56.347648\nZn S\n18 18\ndirect\n0.999995 0.999995 0.000015 Zn\n0.944439 0.944439 0.166682 Zn\n0.907403 0.907403 0.277791 Zn\n0.851849 0.851849 0.444454 Zn\n0.814807 0.814807 0.555579 Zn\n0.759256 0.759256 0.722233 Zn\n0.722212 0.722212 0.833364 Zn\n0.648149 0.648149 0.055554 Zn\n0.592588 0.592588 0.222236 Zn\n0.537034 0.537034 0.388897 Zn\n0.462960 0.462960 0.611121 Zn\n0.407405 0.407405 0.777785 Zn\n0.351852 0.351852 0.944443 Zn\n0.296295 0.296295 0.111115 Zn\n0.222221 0.222221 0.333336 Zn\n0.166667 0.166667 0.500000 Zn\n0.111106 0.111106 0.666683 Zn\n0.037039 0.037039 0.888884 Zn\n0.986119 0.986119 0.041643 S\n0.930581 0.930581 0.208257 S\n0.893526 0.893526 0.319421 S\n0.837992 0.837992 0.486023 S\n0.800930 0.800930 0.597210 S\n0.745401 0.745401 0.763797 S\n0.708345 0.708345 0.874965 S\n0.634273 0.634273 0.097181 S\n0.578699 0.578699 0.263904 S\n0.523163 0.523163 0.430511 S\n0.449083 0.449083 0.652752 S\n0.393519 0.393519 0.819442 S\n0.337959 0.337959 0.986123 S\n0.282423 0.282423 0.152730 S\n0.208345 0.208345 0.374965 S\n0.152775 0.152775 0.541676 S\n0.097235 0.097235 0.708294 S\n0.023175 0.023175 0.930474 S\n",
            "nsites": 36,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.9784254062085243,
            "density_atomic": 0.04915903278336275,
            "volume": 732.3170933538738,
            "volume_molar": 12.250323936475247,
            "formula_full": "Zn18 S18",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -134.96373952,
            "energy_per_atom": -3.748992764444444,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -125.90973952,
            "band_gap": 2.0023,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 2.85e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:57.623000Z",
            "spacegroup": 160
        },
        {
            "id": "mp-608468",
            "created_at": "2022-09-04T14:46:12.494463Z",
            "structure_string": "Zn12 S12\n1.0\n3.851860 -0.011967 37.587618\n1.910581 3.344644 37.587618\n-0.020692 -0.011967 37.784460\nZn S\n12 12\ndirect\n0.083354 0.083354 0.083354 Zn\n0.527805 0.527805 0.527805 Zn\n0.166686 0.166686 0.166686 Zn\n0.388898 0.388898 0.388898 Zn\n0.583359 0.583359 0.583359 Zn\n0.777807 0.777807 0.777807 Zn\n0.277813 0.277813 0.277813 Zn\n0.000022 0.000022 0.000022 Zn\n0.888890 0.888890 0.888890 Zn\n0.638913 0.638913 0.638913 Zn\n0.472231 0.472231 0.472231 Zn\n0.694477 0.694477 0.694477 Zn\n0.298606 0.298606 0.298606 S\n0.798590 0.798590 0.798590 S\n0.548576 0.548576 0.548576 S\n0.409699 0.409699 0.409699 S\n0.659689 0.659689 0.659689 S\n0.604134 0.604134 0.604134 S\n0.020825 0.020825 0.020825 S\n0.493018 0.493018 0.493018 S\n0.909711 0.909711 0.909711 S\n0.104148 0.104148 0.104148 S\n0.187492 0.187492 0.187492 S\n0.715259 0.715259 0.715259 S\n",
            "nsites": 24,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.954793151770918,
            "density_atomic": 0.048867023093089275,
            "volume": 491.1287506562694,
            "volume_molar": 12.323526948895822,
            "formula_full": "Zn12 S12",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -89.02853934,
            "energy_per_atom": -3.7095224725,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -82.99253934,
            "band_gap": 1.9701,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0001062,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:26.808000Z",
            "spacegroup": 160
        },
        {
            "id": "mp-555779",
            "created_at": "2022-09-04T14:46:02.993615Z",
            "structure_string": "Zn16 S16\n1.0\n1.927011 -3.337682 0.000000\n1.927011 3.337682 0.000000\n0.000000 0.000000 50.392951\nZn S\n16 16\ndirect\n0.333333 0.666667 0.625012 Zn\n0.666667 0.333333 0.125013 Zn\n0.000000 0.000000 0.375008 Zn\n0.333333 0.666667 0.062527 Zn\n0.666667 0.333333 0.500008 Zn\n0.333333 0.666667 0.250004 Zn\n0.666667 0.333333 0.312502 Zn\n0.000000 0.000000 0.750003 Zn\n0.666667 0.333333 0.687511 Zn\n0.000000 0.000000 0.187511 Zn\n0.333333 0.666667 0.437516 Zn\n0.333333 0.666667 0.937523 Zn\n0.000000 0.000000 0.562502 Zn\n0.666667 0.333333 0.875003 Zn\n0.333333 0.666667 0.812482 Zn\n0.000000 0.000000 0.000005 Zn\n0.000000 0.000000 0.234352 S\n0.333333 0.666667 0.296855 S\n0.666667 0.333333 0.359367 S\n0.666667 0.333333 0.546866 S\n0.333333 0.666667 0.109367 S\n0.666667 0.333333 0.734352 S\n0.333333 0.666667 0.984324 S\n0.666667 0.333333 0.921905 S\n0.000000 0.000000 0.796850 S\n0.333333 0.666667 0.671867 S\n0.000000 0.000000 0.421865 S\n0.333333 0.666667 0.859314 S\n0.000000 0.000000 0.609363 S\n0.000000 0.000000 0.046909 S\n0.666667 0.333333 0.171868 S\n0.333333 0.666667 0.484365 S\n",
            "nsites": 32,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.9951117448061377,
            "density_atomic": 0.049365215929306434,
            "volume": 648.2297179825096,
            "volume_molar": 12.19915814533055,
            "formula_full": "Zn16 S16",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -120.33649431,
            "energy_per_atom": -3.7605154471875,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -112.28849431,
            "band_gap": 2.0474,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0002666,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:21.551000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-561196",
            "created_at": "2022-09-04T14:40:27.973402Z",
            "structure_string": "Zn14 S14\n1.0\n1.926002 -3.335934 0.000000\n1.926002 3.335934 0.000000\n0.000000 0.000000 44.084819\nZn S\n14 14\ndirect\n0.666667 0.333333 0.071463 Zn\n0.000000 0.000000 0.642877 Zn\n0.333333 0.666667 0.785732 Zn\n0.333333 0.666667 0.571463 Zn\n0.000000 0.000000 0.142877 Zn\n0.000000 0.000000 0.357159 Zn\n0.666667 0.333333 0.928581 Zn\n0.333333 0.666667 0.214307 Zn\n0.666667 0.333333 0.714307 Zn\n0.666667 0.333333 0.285732 Zn\n0.333333 0.666667 0.000012 Zn\n0.666667 0.333333 0.500012 Zn\n0.000000 0.000000 0.857159 Zn\n0.333333 0.666667 0.428581 Zn\n0.333333 0.666667 0.482082 S\n0.333333 0.666667 0.053597 S\n0.666667 0.333333 0.339266 S\n0.000000 0.000000 0.410692 S\n0.666667 0.333333 0.767840 S\n0.000000 0.000000 0.910692 S\n0.000000 0.000000 0.196411 S\n0.666667 0.333333 0.124980 S\n0.333333 0.666667 0.839266 S\n0.666667 0.333333 0.982082 S\n0.666667 0.333333 0.553597 S\n0.333333 0.666667 0.267840 S\n0.000000 0.000000 0.696411 S\n0.333333 0.666667 0.624980 S\n",
            "nsites": 28,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 4.000116871818257,
            "density_atomic": 0.04942706130222451,
            "volume": 566.4912957052503,
            "volume_molar": 12.18389400732786,
            "formula_full": "Zn14 S14",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -105.29177181,
            "energy_per_atom": -3.7604204217857142,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -98.24977181,
            "band_gap": 2.0271,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 1.97e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:03.486000Z",
            "spacegroup": 186
        },
        {
            "id": "mp-554713",
            "created_at": "2022-09-04T14:48:14.260639Z",
            "structure_string": "Zn24 S24\n1.0\n1.926309 -3.336465 0.000000\n1.926309 3.336465 0.000000\n0.000000 0.000000 75.593974\nZn S\n24 24\ndirect\n0.000000 0.000000 0.166668 Zn\n0.333333 0.666667 0.791668 Zn\n0.666667 0.333333 0.458339 Zn\n0.000000 0.000000 0.416669 Zn\n0.666667 0.333333 0.083330 Zn\n0.333333 0.666667 0.333333 Zn\n0.333333 0.666667 0.208343 Zn\n0.000000 0.000000 0.583331 Zn\n0.000000 0.000000 0.708334 Zn\n0.666667 0.333333 0.750002 Zn\n0.666667 0.333333 0.916669 Zn\n0.666667 0.333333 0.625012 Zn\n0.000000 0.000000 0.833331 Zn\n0.333333 0.666667 0.666672 Zn\n0.333333 0.666667 0.125007 Zn\n0.333333 0.666667 0.041677 Zn\n0.000000 0.000000 0.999998 Zn\n0.000000 0.000000 0.291672 Zn\n0.333333 0.666667 0.875007 Zn\n0.333333 0.666667 0.958339 Zn\n0.666667 0.333333 0.541677 Zn\n0.666667 0.333333 0.250001 Zn\n0.666667 0.333333 0.374997 Zn\n0.333333 0.666667 0.499998 Zn\n0.000000 0.000000 0.197939 S\n0.333333 0.666667 0.531272 S\n0.333333 0.666667 0.906223 S\n0.666667 0.333333 0.947940 S\n0.333333 0.666667 0.156222 S\n0.666667 0.333333 0.281248 S\n0.666667 0.333333 0.114603 S\n0.000000 0.000000 0.614604 S\n0.666667 0.333333 0.406223 S\n0.000000 0.000000 0.739579 S\n0.666667 0.333333 0.781248 S\n0.666667 0.333333 0.489553 S\n0.333333 0.666667 0.822891 S\n0.000000 0.000000 0.322915 S\n0.666667 0.333333 0.656247 S\n0.000000 0.000000 0.864604 S\n0.333333 0.666667 0.072890 S\n0.333333 0.666667 0.364577 S\n0.333333 0.666667 0.697916 S\n0.333333 0.666667 0.239576 S\n0.333333 0.666667 0.989553 S\n0.000000 0.000000 0.447939 S\n0.666667 0.333333 0.572890 S\n0.000000 0.000000 0.031272 S\n",
            "nsites": 48,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.9977849418601283,
            "density_atomic": 0.049398247032870275,
            "volume": 971.6943997640268,
            "volume_molar": 12.191000939755584,
            "formula_full": "Zn24 S24",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -180.47805366,
            "energy_per_atom": -3.75995945125,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -168.40605366,
            "band_gap": 2.034,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0016805,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:38:36.132000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-557308",
            "created_at": "2022-09-04T14:41:58.798790Z",
            "structure_string": "Zn10 S10\n1.0\n1.926544 -3.336873 0.000000\n1.926544 3.336873 0.000000\n0.000000 0.000000 31.512556\nZn S\n10 10\ndirect\n0.000000 0.000000 0.600027 Zn\n0.666667 0.333333 0.200027 Zn\n0.666667 0.333333 0.800020 Zn\n0.333333 0.666667 0.700027 Zn\n0.000000 0.000000 0.300027 Zn\n0.000000 0.000000 0.000019 Zn\n0.333333 0.666667 0.900039 Zn\n0.666667 0.333333 0.500027 Zn\n0.333333 0.666667 0.100039 Zn\n0.333333 0.666667 0.400027 Zn\n0.000000 0.000000 0.075005 S\n0.000000 0.000000 0.674974 S\n0.333333 0.666667 0.974936 S\n0.333333 0.666667 0.474973 S\n0.666667 0.333333 0.574972 S\n0.333333 0.666667 0.774941 S\n0.666667 0.333333 0.274973 S\n0.333333 0.666667 0.174968 S\n0.000000 0.000000 0.374973 S\n0.666667 0.333333 0.875006 S\n",
            "nsites": 20,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.9948975810813177,
            "density_atomic": 0.049362569635736875,
            "volume": 405.16529320873644,
            "volume_molar": 12.199812133848415,
            "formula_full": "Zn10 S10",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -75.20938858,
            "energy_per_atom": -3.7604694289999996,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -70.17938858,
            "band_gap": 2.0245,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0041618,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:35.352000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-1244969",
            "created_at": "2022-09-04T14:46:52.262642Z",
            "structure_string": "Zn50 S50\n1.0\n12.906070 -0.033669 0.165617\n0.007202 14.154507 -0.369354\n0.160312 -0.363254 12.750577\nZn S\n50 50\ndirect\n0.549594 0.932032 0.357142 Zn\n0.153276 0.632044 0.798111 Zn\n0.341406 0.625766 0.552866 Zn\n0.071867 0.283564 0.446823 Zn\n0.473992 0.498626 0.760052 Zn\n0.099195 0.832612 0.826994 Zn\n0.575421 0.145206 0.237945 Zn\n0.765621 0.702596 0.297757 Zn\n0.073182 0.384560 0.619410 Zn\n0.330279 0.255010 0.206263 Zn\n0.037650 0.006306 0.365770 Zn\n0.035849 0.134441 0.222457 Zn\n0.361091 0.807824 0.733531 Zn\n0.835179 0.985354 0.900034 Zn\n0.130514 0.130966 0.967266 Zn\n0.182496 0.811788 0.241324 Zn\n0.218131 0.101960 0.726617 Zn\n0.598259 0.363356 0.125958 Zn\n0.870024 0.262462 0.931930 Zn\n0.506539 0.013252 0.643626 Zn\n0.732169 0.865483 0.510415 Zn\n0.569241 0.647369 0.364681 Zn\n0.563689 0.554507 0.914393 Zn\n0.483974 0.988022 0.877198 Zn\n0.727054 0.127962 0.789283 Zn\n0.793190 0.260108 0.362225 Zn\n0.955264 0.485346 0.119306 Zn\n0.975055 0.964002 0.185464 Zn\n0.669193 0.627925 0.624701 Zn\n0.850005 0.105439 0.635097 Zn\n0.323611 0.050273 0.283901 Zn\n0.626686 0.679871 0.168605 Zn\n0.876877 0.703942 0.788965 Zn\n0.087340 0.402482 0.285672 Zn\n0.323341 0.586227 0.356492 Zn\n0.993849 0.465471 0.903147 Zn\n0.458012 0.526682 0.127967 Zn\n0.208741 0.867681 0.495853 Zn\n0.695980 0.847489 0.818084 Zn\n0.659021 0.265965 0.641796 Zn\n0.244694 0.473959 0.474598 Zn\n0.241014 0.911939 0.971144 Zn\n0.961144 0.763127 0.079714 Zn\n0.050872 0.623387 0.307528 Zn\n0.207243 0.554284 0.066405 Zn\n0.488084 0.900111 0.106893 Zn\n0.817066 0.402102 0.724472 Zn\n0.407229 0.210734 0.919664 Zn\n0.913825 0.585750 0.549545 Zn\n0.725150 0.894508 0.041336 Zn\n0.074150 0.600564 0.955163 S\n0.803237 0.239973 0.538603 S\n0.150310 0.989891 0.843327 S\n0.009825 0.645541 0.688923 S\n0.700873 0.680949 0.799908 S\n0.204161 0.134700 0.155060 S\n0.535145 0.125407 0.808125 S\n0.623387 0.992837 0.502523 S\n0.939973 0.815536 0.911298 S\n0.710441 0.304416 0.820826 S\n0.117442 0.418526 0.113376 S\n0.053095 0.094427 0.643665 S\n0.260413 0.761973 0.873515 S\n0.520838 0.877216 0.745588 S\n0.637387 0.520538 0.072421 S\n0.109676 0.869905 0.097511 S\n0.915964 0.635771 0.195230 S\n0.435634 0.311496 0.068134 S\n0.241806 0.218459 0.860487 S\n0.773515 0.495072 0.592411 S\n0.230619 0.338250 0.362107 S\n0.849811 0.415385 0.000431 S\n0.520272 0.673768 0.541357 S\n0.052106 0.128137 0.489677 S\n0.294795 0.543534 0.719435 S\n0.982086 0.356260 0.767423 S\n0.383041 0.000020 0.019801 S\n0.426717 0.175894 0.326824 S\n0.072820 0.849144 0.386660 S\n0.612876 0.988820 0.201986 S\n0.786340 0.712512 0.478175 S\n0.836990 0.859283 0.180462 S\n0.349819 0.080838 0.595829 S\n0.487788 0.280805 0.617538 S\n0.212486 0.648601 0.237203 S\n0.288584 0.006527 0.467398 S\n0.370027 0.583105 0.001357 S\n0.245428 0.763250 0.610651 S\n0.040400 0.514877 0.431747 S\n0.522540 0.420358 0.602758 S\n0.587650 0.777055 0.037002 S\n0.873946 0.947157 0.574471 S\n0.698084 0.257521 0.210392 S\n0.351722 0.879220 0.238946 S\n0.249915 0.415699 0.641235 S\n0.475334 0.513566 0.301219 S\n0.940510 0.122652 0.982564 S\n0.863168 0.889496 0.721542 S\n0.429596 0.811408 0.356803 S\n0.963283 0.273095 0.294980 S\n",
            "nsites": 100,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.4776152100871034,
            "density_atomic": 0.04297081952417845,
            "volume": 2327.1606431367422,
            "volume_molar": 14.01448896410159,
            "formula_full": "Zn50 S50",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -333.33420456,
            "energy_per_atom": -3.3333420456,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -308.18420456,
            "band_gap": 0.2203999999999999,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:44.627000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-561286",
            "created_at": "2022-09-04T14:44:24.862402Z",
            "structure_string": "Zn20 S20\n1.0\n1.926934 -3.337548 0.000000\n1.926934 3.337548 0.000000\n0.000000 0.000000 62.971045\nZn S\n20 20\ndirect\n0.000000 0.000000 0.400003 Zn\n0.333333 0.666667 0.449998 Zn\n0.666667 0.333333 0.200003 Zn\n0.666667 0.333333 0.650003 Zn\n0.333333 0.666667 0.700003 Zn\n0.000000 0.000000 0.600003 Zn\n0.666667 0.333333 0.949998 Zn\n0.000000 0.000000 0.100003 Zn\n0.666667 0.333333 0.350003 Zn\n0.666667 0.333333 0.050014 Zn\n0.000000 0.000000 0.900003 Zn\n0.333333 0.666667 0.550014 Zn\n0.000000 0.000000 0.250003 Zn\n0.333333 0.666667 0.850003 Zn\n0.000000 0.000000 0.750003 Zn\n0.666667 0.333333 0.500000 Zn\n0.333333 0.666667 0.150003 Zn\n0.666667 0.333333 0.800003 Zn\n0.333333 0.666667 0.300003 Zn\n0.333333 0.666667 0.000000 Zn\n0.666667 0.333333 0.237497 S\n0.666667 0.333333 0.837497 S\n0.333333 0.666667 0.887497 S\n0.333333 0.666667 0.337497 S\n0.000000 0.000000 0.787496 S\n0.666667 0.333333 0.087495 S\n0.333333 0.666667 0.487467 S\n0.000000 0.000000 0.287496 S\n0.000000 0.000000 0.137496 S\n0.666667 0.333333 0.687497 S\n0.333333 0.666667 0.037529 S\n0.666667 0.333333 0.987467 S\n0.666667 0.333333 0.537529 S\n0.666667 0.333333 0.387497 S\n0.333333 0.666667 0.737497 S\n0.333333 0.666667 0.187497 S\n0.000000 0.000000 0.637496 S\n0.333333 0.666667 0.587495 S\n0.000000 0.000000 0.937496 S\n0.000000 0.000000 0.437496 S\n",
            "nsites": 40,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.996709891000088,
            "density_atomic": 0.049384963269804114,
            "volume": 809.9631416443223,
            "volume_molar": 12.194280123484816,
            "formula_full": "Zn20 S20",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -150.4222001,
            "energy_per_atom": -3.7605550025,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -140.3622001,
            "band_gap": 2.0626,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 8.5e-06,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:39.772000Z",
            "spacegroup": 186
        },
        {
            "id": "mp-557026",
            "created_at": "2022-09-04T14:40:24.169023Z",
            "structure_string": "Zn18 S18\n1.0\n1.927009 -3.337678 0.000000\n1.927009 3.337678 0.000000\n0.000000 0.000000 56.689739\nZn S\n18 18\ndirect\n0.000000 0.000000 0.166667 Zn\n0.000000 0.000000 0.555549 Zn\n0.333333 0.666667 0.722217 Zn\n0.666667 0.333333 0.277777 Zn\n0.000000 0.000000 0.666679 Zn\n0.333333 0.666667 0.055561 Zn\n0.666667 0.333333 0.611106 Zn\n0.666667 0.333333 0.111112 Zn\n0.666667 0.333333 0.444444 Zn\n0.333333 0.666667 0.222223 Zn\n0.666667 0.333333 0.777776 Zn\n0.666667 0.333333 0.944439 Zn\n0.333333 0.666667 0.388894 Zn\n0.000000 0.000000 0.333332 Zn\n0.333333 0.666667 0.833345 Zn\n0.000000 0.000000 0.000013 Zn\n0.333333 0.666667 0.500013 Zn\n0.000000 0.000000 0.888886 Zn\n0.666667 0.333333 0.986143 S\n0.333333 0.666667 0.541664 S\n0.333333 0.666667 0.430536 S\n0.000000 0.000000 0.041669 S\n0.666667 0.333333 0.486145 S\n0.666667 0.333333 0.652811 S\n0.666667 0.333333 0.152779 S\n0.333333 0.666667 0.763855 S\n0.000000 0.000000 0.708329 S\n0.666667 0.333333 0.819479 S\n0.000000 0.000000 0.375002 S\n0.000000 0.000000 0.930522 S\n0.000000 0.000000 0.597186 S\n0.333333 0.666667 0.263890 S\n0.333333 0.666667 0.874996 S\n0.333333 0.666667 0.097228 S\n0.666667 0.333333 0.319441 S\n0.000000 0.000000 0.208331 S\n",
            "nsites": 36,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.9952849439122913,
            "density_atomic": 0.0493673560474859,
            "volume": 729.2268187377102,
            "volume_molar": 12.198629301126378,
            "formula_full": "Zn18 S18",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -135.36829957,
            "energy_per_atom": -3.760230543611111,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -126.31429957,
            "band_gap": 2.023,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 1.68e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:52.232000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-1244890",
            "created_at": "2022-09-04T14:44:59.687000Z",
            "structure_string": "Zn50 S50\n1.0\n12.311392 0.849521 0.332694\n0.828394 15.298600 0.796408\n0.285984 0.781466 13.385105\nZn S\n50 50\ndirect\n0.446879 0.902803 0.836750 Zn\n0.448883 0.252349 0.101036 Zn\n0.669199 0.046606 0.937017 Zn\n0.668535 0.325693 0.935201 Zn\n0.059395 0.329773 0.300818 Zn\n0.759559 0.261263 0.569030 Zn\n0.631699 0.840544 0.601994 Zn\n0.902928 0.968620 0.101374 Zn\n0.315676 0.100303 0.598469 Zn\n0.594245 0.783132 0.883048 Zn\n0.616493 0.458160 0.549231 Zn\n0.655246 0.072163 0.190800 Zn\n0.608356 0.577344 0.022063 Zn\n0.976235 0.027931 0.904226 Zn\n0.235063 0.627238 0.934338 Zn\n0.599123 0.405567 0.289506 Zn\n0.118505 0.975702 0.419459 Zn\n0.102161 0.694875 0.211010 Zn\n0.936259 0.058581 0.378882 Zn\n0.190756 0.007736 0.706929 Zn\n0.895006 0.405089 0.898062 Zn\n0.749771 0.232065 0.756931 Zn\n0.798846 0.366402 0.321335 Zn\n0.628655 0.059694 0.474348 Zn\n0.285868 0.111800 0.937773 Zn\n0.241421 0.762950 0.640637 Zn\n0.916534 0.769334 0.725904 Zn\n0.534197 0.746104 0.146722 Zn\n0.842237 0.979269 0.617666 Zn\n0.495808 0.255034 0.802686 Zn\n0.303391 0.821243 0.306402 Zn\n0.974759 0.437092 0.520744 Zn\n0.083760 0.641071 0.506816 Zn\n0.314951 0.261332 0.334053 Zn\n0.194234 0.228104 0.161339 Zn\n0.446813 0.904712 0.430099 Zn\n0.668045 0.249649 0.324017 Zn\n0.538024 0.531029 0.797123 Zn\n0.178587 0.191731 0.699821 Zn\n0.356545 0.508541 0.560234 Zn\n0.485840 0.585409 0.281264 Zn\n0.413194 0.741182 0.819522 Zn\n0.238900 0.389580 0.562735 Zn\n0.978572 0.554167 0.334386 Zn\n0.932351 0.226065 0.668927 Zn\n0.165533 0.860488 0.947610 Zn\n0.995872 0.632022 0.028241 Zn\n0.783932 0.627872 0.828481 Zn\n0.168187 0.306255 0.907496 Zn\n0.994758 0.842657 0.578370 Zn\n0.625414 0.129651 0.795576 S\n0.079179 0.970713 0.039275 S\n0.407720 0.272426 0.475551 S\n0.837521 0.267641 0.906375 S\n0.065069 0.326846 0.648243 S\n0.133280 0.189799 0.018646 S\n0.306249 0.337351 0.174525 S\n0.668156 0.715000 0.029481 S\n0.826514 0.028642 0.234567 S\n0.714967 0.500466 0.886481 S\n0.514194 0.567047 0.634267 S\n0.450338 0.764115 0.640943 S\n0.543798 0.184356 0.247459 S\n0.439233 0.605358 0.917860 S\n0.220751 0.623667 0.608993 S\n0.761945 0.155902 0.448907 S\n0.404732 0.909468 0.624439 S\n0.315822 0.643064 0.207315 S\n0.221782 0.760280 0.818564 S\n0.716586 0.762842 0.739309 S\n0.131839 0.504052 0.989565 S\n0.604478 0.330249 0.671073 S\n0.032011 0.098736 0.756556 S\n0.156225 0.191180 0.330702 S\n0.345457 0.771632 0.147788 S\n0.279180 0.978410 0.864777 S\n0.491045 0.476048 0.416850 S\n0.922339 0.593440 0.496517 S\n0.492034 0.336120 0.945888 S\n0.798052 0.399941 0.488150 S\n0.073593 0.445216 0.869625 S\n0.947312 0.660320 0.860369 S\n0.581473 0.706859 0.311018 S\n0.921222 0.367218 0.196694 S\n0.138340 0.747167 0.360943 S\n0.109660 0.437744 0.388481 S\n0.550826 0.016826 0.072848 S\n0.825161 0.954650 0.949525 S\n0.305336 0.233579 0.806472 S\n0.448654 0.748035 0.405883 S\n0.539724 0.493033 0.152106 S\n0.530014 0.967542 0.683411 S\n0.295452 0.965530 0.340120 S\n0.405383 0.105458 0.070679 S\n0.632977 0.915275 0.442290 S\n0.133380 0.726222 0.040894 S\n0.159000 0.909437 0.593721 S\n0.016759 0.851505 0.396279 S\n0.473327 0.146818 0.538771 S\n0.933873 0.644471 0.195899 S\n",
            "nsites": 100,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.2334153750489234,
            "density_atomic": 0.039953387633260035,
            "volume": 2502.9166717455746,
            "volume_molar": 15.072916507802566,
            "formula_full": "Zn50 S50",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -331.23095126,
            "energy_per_atom": -3.3123095125999997,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -306.08095126,
            "band_gap": 0.8751000000000002,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:47.116000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-1245054",
            "created_at": "2022-09-04T14:42:49.928635Z",
            "structure_string": "Zn50 S50\n1.0\n13.394291 -0.174098 -0.018778\n-0.168664 13.930813 0.394010\n-0.007877 0.387700 13.083622\nZn S\n50 50\ndirect\n0.294066 0.309822 0.154770 Zn\n0.521074 0.292258 0.658835 Zn\n0.727119 0.173318 0.655520 Zn\n0.819862 0.979538 0.006111 Zn\n0.310803 0.312357 0.432360 Zn\n0.709609 0.735282 0.235104 Zn\n0.802186 0.983649 0.221322 Zn\n0.992994 0.243169 0.439386 Zn\n0.805864 0.810736 0.749154 Zn\n0.112091 0.001300 0.131102 Zn\n0.557787 0.078824 0.054975 Zn\n0.799479 0.480136 0.863484 Zn\n0.151002 0.467053 0.660598 Zn\n0.865870 0.797927 0.068368 Zn\n0.544282 0.802784 0.655868 Zn\n0.629723 0.296024 0.106944 Zn\n0.533460 0.805821 0.103195 Zn\n0.029247 0.887277 0.790243 Zn\n0.028047 0.341475 0.131688 Zn\n0.025179 0.672505 0.656578 Zn\n0.192896 0.781365 0.204542 Zn\n0.229971 0.790165 0.917554 Zn\n0.814282 0.323558 0.720001 Zn\n0.115561 0.135483 0.504963 Zn\n0.797274 0.609848 0.426630 Zn\n0.981866 0.627365 0.223902 Zn\n0.765824 0.187067 0.851145 Zn\n0.118909 0.408028 0.417106 Zn\n0.709951 0.345550 0.441677 Zn\n0.484670 0.228515 0.855016 Zn\n0.683060 0.058140 0.350348 Zn\n0.342745 0.290900 0.739127 Zn\n0.797468 0.161222 0.228047 Zn\n0.114303 0.115211 0.989225 Zn\n0.580377 0.683017 0.837122 Zn\n0.474732 0.935423 0.896835 Zn\n0.849716 0.866235 0.493324 Zn\n0.100262 0.610265 0.445839 Zn\n0.159977 0.422049 0.930644 Zn\n0.416386 0.100187 0.387475 Zn\n0.070968 0.578510 0.904308 Zn\n0.527681 0.841779 0.367030 Zn\n0.081054 0.294553 0.661355 Zn\n0.198203 0.937843 0.398374 Zn\n0.348696 0.916283 0.696140 Zn\n0.845601 0.405873 0.252700 Zn\n0.979705 0.428987 0.577726 Zn\n0.181613 0.548350 0.072796 Zn\n0.365504 0.119926 0.558733 Zn\n0.368113 0.483363 0.285368 Zn\n0.452455 0.948467 0.064124 S\n0.661711 0.250023 0.275105 S\n0.729633 0.484759 0.340557 S\n0.269146 0.945098 0.851327 S\n0.381753 0.458259 0.448362 S\n0.731129 0.117391 0.014643 S\n0.239184 0.936287 0.234716 S\n0.075321 0.726485 0.321238 S\n0.545906 0.071108 0.806808 S\n0.858186 0.309423 0.539928 S\n0.955194 0.339841 0.837035 S\n0.942895 0.545905 0.791204 S\n0.101539 0.733578 0.824343 S\n0.259710 0.421596 0.789257 S\n0.937469 0.580854 0.519855 S\n0.884165 0.431302 0.079149 S\n0.947163 0.932862 0.143013 S\n0.488661 0.231573 0.034430 S\n0.445754 0.803033 0.804687 S\n0.996330 0.150706 0.717597 S\n0.745961 0.764659 0.412069 S\n0.962951 0.187521 0.864196 S\n0.300559 0.211905 0.300472 S\n0.127615 0.978263 0.538167 S\n0.157599 0.283076 0.038958 S\n0.249817 0.239893 0.593750 S\n0.535523 0.719720 0.260214 S\n0.680361 0.714668 0.698549 S\n0.338993 0.468269 0.122761 S\n0.181564 0.620277 0.596373 S\n0.834172 0.652241 0.146676 S\n0.877650 0.871116 0.893162 S\n0.448877 0.778407 0.515990 S\n0.137443 0.020337 0.809810 S\n0.761773 0.016575 0.631351 S\n0.808521 0.030434 0.477124 S\n0.943274 0.823101 0.638155 S\n0.708854 0.879339 0.119514 S\n0.072511 0.488850 0.209477 S\n0.702789 0.455900 0.721630 S\n0.615258 0.690972 0.012157 S\n0.320682 0.861953 0.535163 S\n0.608099 0.233265 0.533811 S\n0.249676 0.706832 0.070227 S\n0.528610 0.572984 0.956204 S\n0.529182 0.002587 0.312489 S\n0.480762 0.038120 0.662754 S\n0.754577 0.379987 0.004442 S\n0.565830 0.395755 0.775257 S\n0.934995 0.259884 0.267745 S\n",
            "nsites": 100,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.318305032905364,
            "density_atomic": 0.041002318566342476,
            "volume": 2438.8864702418773,
            "volume_molar": 14.687317621456137,
            "formula_full": "Zn50 S50",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -328.50380861,
            "energy_per_atom": -3.2850380861,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -303.35380861,
            "band_gap": 0.91,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:52.506000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-1201158",
            "created_at": "2022-09-04T14:46:31.100592Z",
            "structure_string": "Zn18 S18\n1.0\n-1.937434 -3.355735 0.000000\n1.937434 -3.355735 0.000000\n0.000000 -2.237156 56.512738\nZn S\n18 18\ndirect\n0.999993 0.999993 0.000021 Zn\n0.944438 0.944438 0.166686 Zn\n0.888879 0.888879 0.333363 Zn\n0.851838 0.851838 0.444487 Zn\n0.759256 0.759256 0.722233 Zn\n0.722209 0.722209 0.833374 Zn\n0.629629 0.629629 0.111114 Zn\n0.574063 0.574063 0.277810 Zn\n0.499992 0.499992 0.500025 Zn\n0.462953 0.462953 0.611140 Zn\n0.407405 0.407405 0.777786 Zn\n0.351845 0.351845 0.944466 Zn\n0.314807 0.314807 0.055580 Zn\n0.259253 0.259253 0.222241 Zn\n0.203692 0.203692 0.388924 Zn\n0.148143 0.148143 0.555571 Zn\n0.111102 0.111102 0.666693 Zn\n0.037030 0.037030 0.888911 Zn\n0.986111 0.986111 0.041666 S\n0.930565 0.930565 0.208304 S\n0.875024 0.875024 0.374929 S\n0.837979 0.837979 0.486063 S\n0.745397 0.745397 0.763809 S\n0.708351 0.708351 0.874948 S\n0.615750 0.615750 0.152749 S\n0.560199 0.560199 0.319403 S\n0.486140 0.486140 0.541579 S\n0.449075 0.449075 0.652774 S\n0.393527 0.393527 0.819419 S\n0.337979 0.337979 0.986063 S\n0.300931 0.300931 0.097206 S\n0.245385 0.245385 0.263844 S\n0.189819 0.189819 0.430544 S\n0.134278 0.134278 0.597167 S\n0.097234 0.097234 0.708299 S\n0.023180 0.023180 0.930461 S\n",
            "nsites": 36,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.964783449262998,
            "density_atomic": 0.0489904672479457,
            "volume": 734.8368370891498,
            "volume_molar": 12.292474634955692,
            "formula_full": "Zn18 S18",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -134.95259595,
            "energy_per_atom": -3.748683220833333,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -125.89859595,
            "band_gap": 2.0046,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 2.74e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:34.912000Z",
            "spacegroup": 160
        }
    ]
}