GET /third-parties/MatprojStructure/?format=api&ordering=-energy_above_hull&page=12102
HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept

{
    "count": 146323,
    "next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-energy_above_hull&page=12103",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-energy_above_hull&page=12101",
    "results": [
        {
            "id": "mp-4236",
            "created_at": "2022-09-04T14:40:22.623227Z",
            "structure_string": "Ba3 Zn3 O6\n1.0\n2.986150 -5.172164 0.000000\n2.986150 5.172164 0.000000\n0.000000 0.000000 6.826996\nBa Zn O\n3 3 6\ndirect\n0.653959 0.000000 0.833333 Ba\n0.000000 0.653959 0.166667 Ba\n0.346041 0.346041 0.500000 Ba\n0.415945 0.415945 0.000000 Zn\n0.000000 0.584055 0.666667 Zn\n0.584055 0.000000 0.333333 Zn\n0.123916 0.421197 0.876173 O\n0.578803 0.702719 0.209506 O\n0.297281 0.876084 0.542840 O\n0.702719 0.578803 0.790494 O\n0.421197 0.123916 0.123827 O\n0.876084 0.297281 0.457160 O\n",
            "nsites": 12,
            "nelements": 3,
            "elements": [
                "Ba",
                "Zn",
                "O"
            ],
            "chemical_system": "Ba-O-Zn",
            "density": 5.545034865472373,
            "density_atomic": 0.05690333174377586,
            "volume": 210.8839611366442,
            "volume_molar": 10.583107483260338,
            "formula_full": "Ba3 Zn3 O6",
            "formula_reduced": "BaZnO2",
            "formula_anonymous": "ABC2",
            "energy": -67.60898398,
            "energy_per_atom": -5.6340819983333335,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -63.48698397999999,
            "band_gap": 2.2724,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0003249,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:47.203000Z",
            "spacegroup": 152
        },
        {
            "id": "mp-648086",
            "created_at": "2022-09-04T14:40:22.632132Z",
            "structure_string": "Gd2 Ga4 Co2\n1.0\n3.982947 -0.000069 -0.000762\n0.000205 4.031053 -0.930073\n-0.001978 -0.004404 9.214407\nGd Ga Co\n2 4 2\ndirect\n0.001535 0.138468 0.281923 Gd\n0.002002 0.860888 0.717744 Gd\n0.502441 0.292026 0.582863 Ga\n0.502864 0.708102 0.416911 Ga\n0.001762 0.500630 0.999981 Ga\n0.501039 0.003353 0.999807 Ga\n0.501690 0.428780 0.850152 Co\n0.502130 0.579264 0.149796 Co\n",
            "nsites": 8,
            "nelements": 3,
            "elements": [
                "Gd",
                "Ga",
                "Co"
            ],
            "chemical_system": "Co-Ga-Gd",
            "density": 7.984247399097355,
            "density_atomic": 0.054081343593452014,
            "volume": 147.9253189443432,
            "volume_molar": 11.135338658134117,
            "formula_full": "Gd2 Ga4 Co2",
            "formula_reduced": "GdGa2Co",
            "formula_anonymous": "ABC2",
            "energy": -58.80166125,
            "energy_per_atom": -7.35020765625,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -58.80166125,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 14.1427455,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:54.308000Z",
            "spacegroup": 65
        },
        {
            "id": "mp-1221577",
            "created_at": "2022-09-04T14:40:22.639061Z",
            "structure_string": "Mo4 Pd2 Rh4\n1.0\n1.389102 -2.405995 0.000000\n1.389102 2.405995 0.000000\n0.000000 0.000000 22.482440\nMo Pd Rh\n4 2 4\ndirect\n0.000000 0.000000 0.548333 Mo\n0.000000 0.000000 0.748751 Mo\n0.000000 0.000000 0.945345 Mo\n0.666667 0.333333 0.052478 Mo\n0.000000 0.000000 0.150316 Pd\n0.000000 0.000000 0.350968 Pd\n0.666667 0.333333 0.251665 Rh\n0.666667 0.333333 0.454309 Rh\n0.666667 0.333333 0.650059 Rh\n0.666667 0.333333 0.847778 Rh\n",
            "nsites": 10,
            "nelements": 3,
            "elements": [
                "Mo",
                "Pd",
                "Rh"
            ],
            "chemical_system": "Mo-Pd-Rh",
            "density": 11.14045609555425,
            "density_atomic": 0.06654228410133121,
            "volume": 150.2803838950269,
            "volume_molar": 9.05009625282689,
            "formula_full": "Mo4 Pd2 Rh4",
            "formula_reduced": "Mo2PdRh2",
            "formula_anonymous": "AB2C2",
            "energy": -83.31090447,
            "energy_per_atom": -8.331090447,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -83.31090447,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 0.5027211,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:55.553000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-1315",
            "created_at": "2022-09-04T14:40:22.676529Z",
            "structure_string": "Mg1 S1\n1.0\n0.000000 2.614502 2.614502\n2.614502 0.000000 2.614502\n2.614502 2.614502 0.000000\nMg S\n1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 S\n",
            "nsites": 2,
            "nelements": 2,
            "elements": [
                "Mg",
                "S"
            ],
            "chemical_system": "Mg-S",
            "density": 2.6187871513749923,
            "density_atomic": 0.05595424818701314,
            "volume": 35.74348802463574,
            "volume_molar": 10.762615806886538,
            "formula_full": "Mg1 S1",
            "formula_reduced": "MgS",
            "formula_anonymous": "AB",
            "energy": -9.09171717,
            "energy_per_atom": -4.545858585,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -8.58871717,
            "band_gap": 2.7574,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0009786,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:52.980000Z",
            "spacegroup": 225
        },
        {
            "id": "mp-1209141",
            "created_at": "2022-09-04T14:40:22.682996Z",
            "structure_string": "Rb6 Zr6 F30\n1.0\n7.304954 0.016903 2.588967\n3.163348 7.902312 2.423963\n0.034006 0.015273 11.154470\nRb Zr F\n6 6 30\ndirect\n0.723697 0.676058 0.079888 Rb\n0.276303 0.323942 0.920112 Rb\n0.215929 0.005844 0.266495 Rb\n0.784071 0.994156 0.733505 Rb\n0.243771 0.655675 0.571807 Rb\n0.756229 0.344325 0.428193 Rb\n0.265838 0.159072 0.580797 Zr\n0.734162 0.840928 0.419203 Zr\n0.760633 0.167036 0.067770 Zr\n0.239367 0.832964 0.932230 Zr\n0.217967 0.529544 0.244324 Zr\n0.782033 0.470456 0.755676 Zr\n0.105030 0.381821 0.697650 F\n0.894970 0.618179 0.302350 F\n0.177747 0.370554 0.438562 F\n0.822253 0.629446 0.561438 F\n0.470138 0.220754 0.611520 F\n0.529862 0.779246 0.388480 F\n0.087943 0.055390 0.033513 F\n0.912057 0.944610 0.966487 F\n0.314584 0.738769 0.120915 F\n0.685416 0.261231 0.879085 F\n0.074356 0.732873 0.359215 F\n0.925644 0.267127 0.640785 F\n0.165514 0.016628 0.526586 F\n0.834486 0.983372 0.473414 F\n0.156369 0.342219 0.217727 F\n0.843631 0.657781 0.782273 F\n0.491652 0.385542 0.115122 F\n0.508348 0.614458 0.884878 F\n0.432839 0.510040 0.319107 F\n0.567161 0.489960 0.680893 F\n0.544529 0.079763 0.096198 F\n0.455471 0.920237 0.903802 F\n0.492311 0.095908 0.400364 F\n0.507689 0.904092 0.599636 F\n0.189071 0.049159 0.775185 F\n0.810929 0.950841 0.224815 F\n0.813696 0.252683 0.195736 F\n0.186304 0.747317 0.804264 F\n0.133834 0.629986 0.057482 F\n0.866166 0.370014 0.942518 F\n",
            "nsites": 42,
            "nelements": 3,
            "elements": [
                "Rb",
                "Zr",
                "F"
            ],
            "chemical_system": "F-Rb-Zr",
            "density": 4.213211096022486,
            "density_atomic": 0.06537299666177632,
            "volume": 642.4671063695854,
            "volume_molar": 9.211969876732228,
            "formula_full": "Rb6 Zr6 F30",
            "formula_reduced": "RbZrF5",
            "formula_anonymous": "ABC5",
            "energy": -274.18897813,
            "energy_per_atom": -6.528309003095238,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -260.32897813,
            "band_gap": 5.5318000000000005,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.002048,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:02.919000Z",
            "spacegroup": 2
        },
        {
            "id": "mp-568769",
            "created_at": "2022-09-04T14:40:22.781134Z",
            "structure_string": "La2 Co4\n1.0\n0.000000 3.675293 3.675293\n3.675293 0.000000 3.675293\n3.675293 3.675293 0.000000\nLa Co\n2 4\ndirect\n0.250000 0.250000 0.250000 La\n0.000000 0.000000 0.000000 La\n0.625000 0.625000 0.125000 Co\n0.625000 0.125000 0.625000 Co\n0.125000 0.625000 0.625000 Co\n0.625000 0.625000 0.625000 Co\n",
            "nsites": 6,
            "nelements": 2,
            "elements": [
                "La",
                "Co"
            ],
            "chemical_system": "Co-La",
            "density": 8.58856530472552,
            "density_atomic": 0.06042899234680534,
            "volume": 99.29008853177076,
            "volume_molar": 9.965648153519757,
            "formula_full": "La2 Co4",
            "formula_reduced": "LaCo2",
            "formula_anonymous": "AB2",
            "energy": -38.58171373,
            "energy_per_atom": -6.430285621666666,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -38.58171373,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 2.4312022,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:52.054000Z",
            "spacegroup": 227
        },
        {
            "id": "mp-756490",
            "created_at": "2022-09-04T14:40:23.447360Z",
            "structure_string": "Li12 Mn2 S8\n1.0\n8.047112 0.000000 0.000000\n0.000000 8.047112 0.000000\n0.000000 0.000000 5.803860\nLi Mn S\n12 2 8\ndirect\n0.274322 0.274322 0.500000 Li\n0.725678 0.274322 0.500000 Li\n0.000000 0.500000 0.462347 Li\n0.000000 0.500000 0.962347 Li\n0.274322 0.725678 0.500000 Li\n0.725678 0.725678 0.500000 Li\n0.774322 0.774322 0.000000 Li\n0.225678 0.774322 0.000000 Li\n0.500000 0.000000 0.037653 Li\n0.500000 0.000000 0.537653 Li\n0.774322 0.225678 0.000000 Li\n0.225678 0.225678 0.000000 Li\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.000000 0.256917 0.715703 S\n0.756917 0.500000 0.215703 S\n0.243083 0.500000 0.215703 S\n0.000000 0.743083 0.715703 S\n0.500000 0.756917 0.784297 S\n0.743083 0.000000 0.284297 S\n0.256917 0.000000 0.284297 S\n0.500000 0.243083 0.784297 S\n",
            "nsites": 22,
            "nelements": 3,
            "elements": [
                "Li",
                "Mn",
                "S"
            ],
            "chemical_system": "Li-Mn-S",
            "density": 1.9868426002092043,
            "density_atomic": 0.05853635301577593,
            "volume": 375.83482513970176,
            "volume_molar": 10.287864634096685,
            "formula_full": "Li12 Mn2 S8",
            "formula_reduced": "Li6MnS4",
            "formula_anonymous": "AB4C6",
            "energy": -104.67016439,
            "energy_per_atom": -4.757734745,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -100.64616439,
            "band_gap": 1.5491,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 9.9995234,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:02.420000Z",
            "spacegroup": 137
        },
        {
            "id": "mp-627557",
            "created_at": "2022-09-04T14:40:22.631824Z",
            "structure_string": "Cd9 I18\n1.0\n2.173073 -3.763873 0.000000\n2.173073 3.763873 0.000000\n0.000000 0.000000 66.137812\nCd I\n9 18\ndirect\n0.000000 0.000000 0.583320 Cd\n0.000000 0.000000 0.805576 Cd\n0.333333 0.666667 0.472238 Cd\n0.000000 0.000000 0.027778 Cd\n0.333333 0.666667 0.138906 Cd\n0.333333 0.666667 0.361081 Cd\n0.000000 0.000000 0.694435 Cd\n0.000000 0.000000 0.916658 Cd\n0.000000 0.000000 0.249985 Cd\n0.000000 0.000000 0.334986 I\n0.666667 0.333333 0.720545 I\n0.333333 0.666667 0.557221 I\n0.333333 0.666667 0.779474 I\n0.333333 0.666667 0.223887 I\n0.666667 0.333333 0.276091 I\n0.333333 0.666667 0.668345 I\n0.666667 0.333333 0.053884 I\n0.666667 0.333333 0.609418 I\n0.666667 0.333333 0.942753 I\n0.000000 0.000000 0.112820 I\n0.333333 0.666667 0.001700 I\n0.000000 0.000000 0.446133 I\n0.666667 0.333333 0.165001 I\n0.666667 0.333333 0.387170 I\n0.666667 0.333333 0.831686 I\n0.666667 0.333333 0.498352 I\n0.333333 0.666667 0.890556 I\n",
            "nsites": 27,
            "nelements": 2,
            "elements": [
                "Cd",
                "I"
            ],
            "chemical_system": "Cd-I",
            "density": 5.058764918669716,
            "density_atomic": 0.0249559822623314,
            "volume": 1081.9049202785275,
            "volume_molar": 24.131050810569896,
            "formula_full": "Cd9 I18",
            "formula_reduced": "CdI2",
            "formula_anonymous": "AB2",
            "energy": -58.34960427,
            "energy_per_atom": -2.1610964544444444,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -51.52760427,
            "band_gap": 2.291,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 4e-06,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:52.887000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-1271729",
            "created_at": "2022-09-04T14:40:22.645728Z",
            "structure_string": "Fe12 O16\n1.0\n1.756432 4.941522 3.059892\n0.011397 0.014311 6.090709\n10.501013 0.001087 0.019429\nFe O\n12 16\ndirect\n0.499527 0.749661 0.750806 Fe\n0.500900 0.001324 0.496820 Fe\n0.000584 0.749690 0.249191 Fe\n0.500857 0.746524 0.246825 Fe\n0.500439 0.251605 0.752084 Fe\n0.131412 0.187997 0.062979 Fe\n0.130956 0.688141 0.562840 Fe\n0.869526 0.312876 0.437367 Fe\n0.868808 0.810742 0.937454 Fe\n0.499657 0.251084 0.249293 Fe\n0.498669 0.498887 0.002028 Fe\n0.998769 0.250303 0.750457 Fe\n0.256157 0.380112 0.125896 O\n0.267587 0.878401 0.625971 O\n0.736804 0.119093 0.381543 O\n0.738852 0.623652 0.866837 O\n0.746386 0.865092 0.131004 O\n0.727596 0.387840 0.634360 O\n0.741205 0.391017 0.131539 O\n0.729081 0.883376 0.627706 O\n0.264375 0.107260 0.379577 O\n0.264916 0.619515 0.861815 O\n0.258809 0.870774 0.132397 O\n0.271705 0.354113 0.623209 O\n0.251755 0.635749 0.371102 O\n0.273294 0.112359 0.863765 O\n0.730452 0.644144 0.378382 O\n0.740922 0.128670 0.866754 O\n",
            "nsites": 28,
            "nelements": 2,
            "elements": [
                "Fe",
                "O"
            ],
            "chemical_system": "Fe-O",
            "density": 4.873158960067088,
            "density_atomic": 0.08872527864095427,
            "volume": 315.580862961366,
            "volume_molar": 6.78740134969863,
            "formula_full": "Fe12 O16",
            "formula_reduced": "Fe3O4",
            "formula_anonymous": "A3B4",
            "energy": -225.14360051,
            "energy_per_atom": -8.040842875357143,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -187.07960051,
            "band_gap": 0.1220999999999996,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 55.9999609,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:50.494000Z",
            "spacegroup": 5
        },
        {
            "id": "mp-1239191",
            "created_at": "2022-09-04T14:40:22.646939Z",
            "structure_string": "Cs4 Cr8 S16\n1.0\n3.594919 0.000000 0.000000\n0.000000 12.069073 0.000000\n0.000000 0.000000 13.287917\nCs Cr S\n4 8 16\ndirect\n0.250000 0.243241 0.337440 Cs\n0.750000 0.756759 0.662560 Cs\n0.750000 0.256759 0.837440 Cs\n0.250000 0.743241 0.162560 Cs\n0.250000 0.071991 0.101075 Cr\n0.750000 0.928009 0.898925 Cr\n0.750000 0.428009 0.601075 Cr\n0.250000 0.571991 0.398925 Cr\n0.250000 0.069204 0.603984 Cr\n0.750000 0.930796 0.396016 Cr\n0.750000 0.430796 0.103984 Cr\n0.250000 0.569204 0.896016 Cr\n0.750000 0.020893 0.714779 S\n0.250000 0.979107 0.285221 S\n0.250000 0.479107 0.214779 S\n0.750000 0.520893 0.785221 S\n0.250000 0.054453 0.925337 S\n0.750000 0.945547 0.074663 S\n0.750000 0.445547 0.425337 S\n0.250000 0.554453 0.574663 S\n0.750000 0.098958 0.491062 S\n0.250000 0.901042 0.508938 S\n0.250000 0.401042 0.991062 S\n0.750000 0.598958 0.008938 S\n0.750000 0.203909 0.122655 S\n0.250000 0.796091 0.877345 S\n0.250000 0.296091 0.622655 S\n0.750000 0.703909 0.377345 S\n",
            "nsites": 28,
            "nelements": 3,
            "elements": [
                "Cs",
                "Cr",
                "S"
            ],
            "chemical_system": "Cr-Cs-S",
            "density": 4.206971445387477,
            "density_atomic": 0.04856664475206493,
            "volume": 576.5273706458693,
            "volume_molar": 12.399746350078988,
            "formula_full": "Cs4 Cr8 S16",
            "formula_reduced": "Cs(CrS2)2",
            "formula_anonymous": "AB2C4",
            "energy": -173.65545689,
            "energy_per_atom": -6.201980603214286,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -165.60745689,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 20.0004319,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:53.380000Z",
            "spacegroup": 62
        },
        {
            "id": "mp-1212277",
            "created_at": "2022-09-04T14:40:22.651918Z",
            "structure_string": "Li2 N12 O12\n1.0\n5.997823 3.339936 0.000000\n-5.997823 3.339936 0.000000\n0.000000 0.187168 23.912121\nLi N O\n2 12 12\ndirect\n0.000000 0.500000 0.000000 Li\n0.500000 0.000000 0.500000 Li\n0.998817 0.504221 0.250154 N\n0.001183 0.495779 0.749846 N\n0.827296 0.724429 0.999842 N\n0.495779 0.001183 0.249846 N\n0.172704 0.275571 0.000158 N\n0.504221 0.998817 0.750154 N\n0.308589 0.472595 0.000051 N\n0.275571 0.172704 0.500158 N\n0.691411 0.527405 0.999949 N\n0.724429 0.827296 0.499842 N\n0.527405 0.691411 0.499949 N\n0.472595 0.308589 0.500051 N\n0.017867 0.665783 0.224022 O\n0.982133 0.334217 0.775978 O\n0.348398 0.674061 0.999956 O\n0.334217 0.982133 0.275978 O\n0.651602 0.325939 0.000044 O\n0.665783 0.017867 0.724022 O\n0.135890 0.499777 0.281214 O\n0.325939 0.651602 0.500044 O\n0.864110 0.500223 0.718786 O\n0.674061 0.348398 0.499956 O\n0.500223 0.864110 0.218786 O\n0.499777 0.135890 0.781214 O\n",
            "nsites": 26,
            "nelements": 3,
            "elements": [
                "Li",
                "N",
                "O"
            ],
            "chemical_system": "Li-N-O",
            "density": 0.648169794618234,
            "density_atomic": 0.02713897634367048,
            "volume": 958.0317131623824,
            "volume_molar": 22.190007035414663,
            "formula_full": "Li2 N12 O12",
            "formula_reduced": "Li(NO)6",
            "formula_anonymous": "AB6C6",
            "energy": -170.62455573,
            "energy_per_atom": -6.562482912692308,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -162.38055573,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 1.331832,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:54.646000Z",
            "spacegroup": 15
        },
        {
            "id": "mp-1072429",
            "created_at": "2022-09-04T14:40:22.654631Z",
            "structure_string": "Ga4 Ru2\n1.0\n0.000000 4.142247 4.390920\n2.391227 0.000000 4.390920\n2.391227 4.142247 0.000000\nGa Ru\n4 2\ndirect\n0.418832 0.081168 0.418832 Ga\n0.081168 0.418832 0.081168 Ga\n0.831168 0.168832 0.831168 Ga\n0.168832 0.831168 0.168832 Ga\n0.750000 0.750000 0.750000 Ru\n0.500000 0.500000 0.500000 Ru\n",
            "nsites": 6,
            "nelements": 2,
            "elements": [
                "Ga",
                "Ru"
            ],
            "chemical_system": "Ga-Ru",
            "density": 9.182918872761038,
            "density_atomic": 0.06897773544197262,
            "volume": 86.98458947014124,
            "volume_molar": 8.730557362333407,
            "formula_full": "Ga4 Ru2",
            "formula_reduced": "Ga2Ru",
            "formula_anonymous": "AB2",
            "energy": -33.14147783,
            "energy_per_atom": -5.5235796383333335,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -33.14147783,
            "band_gap": 0.1268000000000002,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0009118,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:48.030000Z",
            "spacegroup": 70
        }
    ]
}