GET /third-parties/MatprojStructure/?format=api&ordering=band_gap&page=61
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=band_gap&page=62",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=band_gap&page=60",
    "results": [
        {
            "id": "mp-1216419",
            "created_at": "2022-09-04T14:39:09.349318Z",
            "structure_string": "Yb16 Sb8 S45\n1.0\n12.377764 5.609533 0.000000\n-12.377764 5.609533 0.000000\n0.000000 5.501718 13.099478\nYb Sb S\n16 8 45\ndirect\n0.503337 0.659308 0.839557 Yb\n0.005506 0.164114 0.830694 Yb\n0.835886 0.994494 0.169306 Yb\n0.340692 0.496663 0.160443 Yb\n0.908552 0.252404 0.339291 Yb\n0.407211 0.751323 0.339357 Yb\n0.248677 0.592789 0.660643 Yb\n0.747596 0.091448 0.660709 Yb\n0.994494 0.835886 0.169306 Yb\n0.496663 0.340692 0.160443 Yb\n0.659308 0.503337 0.839557 Yb\n0.164114 0.005506 0.830694 Yb\n0.592789 0.248677 0.660643 Yb\n0.091448 0.747596 0.660709 Yb\n0.252404 0.908552 0.339291 Yb\n0.751323 0.407211 0.339357 Yb\n0.811994 0.312160 0.814735 Sb\n0.312160 0.811994 0.814735 Sb\n0.188006 0.687840 0.185265 Sb\n0.687840 0.188006 0.185265 Sb\n0.125685 0.125685 0.315612 Sb\n0.623670 0.623670 0.315890 Sb\n0.376330 0.376330 0.684110 Sb\n0.874315 0.874315 0.684388 Sb\n0.951845 0.225096 0.001221 S\n0.440012 0.734243 0.003083 S\n0.265757 0.559988 0.996917 S\n0.774904 0.048155 0.998779 S\n0.807529 0.013065 0.502237 S\n0.307581 0.512759 0.502449 S\n0.487241 0.692419 0.497551 S\n0.986935 0.192471 0.497763 S\n0.559988 0.265757 0.996917 S\n0.048155 0.774904 0.998779 S\n0.225096 0.951845 0.001221 S\n0.734243 0.440012 0.003083 S\n0.692419 0.487241 0.497551 S\n0.192471 0.986935 0.497763 S\n0.013065 0.807529 0.502237 S\n0.512759 0.307581 0.502449 S\n0.818476 0.475479 0.704450 S\n0.320296 0.976080 0.702246 S\n0.023920 0.679704 0.297754 S\n0.524521 0.181524 0.295550 S\n0.226630 0.069926 0.205323 S\n0.725731 0.569254 0.205569 S\n0.430746 0.274269 0.794431 S\n0.930074 0.773370 0.794677 S\n0.679704 0.023920 0.297754 S\n0.181524 0.524521 0.295550 S\n0.475479 0.818476 0.704450 S\n0.976080 0.320296 0.702246 S\n0.274269 0.430746 0.794431 S\n0.773370 0.930074 0.794677 S\n0.069926 0.226630 0.205323 S\n0.569254 0.725731 0.205569 S\n0.594563 0.094177 0.815106 S\n0.094177 0.594563 0.815106 S\n0.405437 0.905823 0.184894 S\n0.905823 0.405437 0.184894 S\n0.841911 0.841911 0.316751 S\n0.343337 0.343337 0.314803 S\n0.656663 0.656663 0.685197 S\n0.158089 0.158089 0.683249 S\n0.909270 0.909270 0.002474 S\n0.090730 0.090730 0.997526 S\n0.500000 0.500000 0.000000 S\n0.749995 0.250005 0.500000 S\n0.250005 0.749995 0.500000 S\n",
            "nsites": 69,
            "nelements": 3,
            "elements": [
                "Yb",
                "Sb",
                "S"
            ],
            "chemical_system": "S-Sb-Yb",
            "density": 4.733681015576521,
            "density_atomic": 0.037931166605174725,
            "volume": 1819.084572805803,
            "volume_molar": 15.876497611276834,
            "formula_full": "Yb16 Sb8 S45",
            "formula_reduced": "Yb16Sb8S45",
            "formula_anonymous": "A8B16C45",
            "energy": -329.31726687,
            "energy_per_atom": -4.772714012608696,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -306.68226687,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 1.2541166,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:33.106000Z",
            "spacegroup": 12
        },
        {
            "id": "mp-758919",
            "created_at": "2022-09-04T14:39:09.526433Z",
            "structure_string": "Li4 Fe4 P4 O20\n1.0\n2.659982 6.653261 0.000000\n-2.659982 6.653261 0.000000\n0.000000 3.938286 9.959117\nLi Fe P O\n4 4 4 20\ndirect\n0.989777 0.010223 0.750000 Li\n0.000000 0.500000 0.000000 Li\n0.010223 0.989777 0.250000 Li\n0.500000 0.000000 0.500000 Li\n0.500000 0.000000 0.000000 Fe\n0.000000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.000000 0.500000 0.500000 Fe\n0.618734 0.629428 0.815960 P\n0.629428 0.618734 0.315960 P\n0.381266 0.370572 0.184040 P\n0.370572 0.381266 0.684040 P\n0.310328 0.317639 0.836582 O\n0.689801 0.711918 0.896315 O\n0.162705 0.092023 0.041762 O\n0.309018 0.791161 0.852605 O\n0.802488 0.316764 0.853317 O\n0.837295 0.907977 0.958238 O\n0.689672 0.682361 0.163418 O\n0.310199 0.288082 0.103685 O\n0.791161 0.309018 0.352605 O\n0.316764 0.802488 0.353317 O\n0.690982 0.208839 0.147395 O\n0.197512 0.683236 0.146683 O\n0.317639 0.310328 0.336582 O\n0.711918 0.689801 0.396315 O\n0.092023 0.162705 0.541762 O\n0.208839 0.690982 0.647395 O\n0.683236 0.197512 0.646683 O\n0.907977 0.837295 0.458238 O\n0.288082 0.310199 0.603685 O\n0.682361 0.689672 0.663418 O\n",
            "nsites": 32,
            "nelements": 4,
            "elements": [
                "Li",
                "Fe",
                "P",
                "O"
            ],
            "chemical_system": "Fe-Li-O-P",
            "density": 3.2740606106106114,
            "density_atomic": 0.09077910354099429,
            "volume": 352.5040317846865,
            "volume_molar": 6.63384030585905,
            "formula_full": "Li4 Fe4 P4 O20",
            "formula_reduced": "LiFePO5",
            "formula_anonymous": "ABCD5",
            "energy": -231.41861125,
            "energy_per_atom": -7.2318316015625,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -208.65461125,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 16.0025154,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:36.292000Z",
            "spacegroup": 15
        },
        {
            "id": "mp-867338",
            "created_at": "2022-09-04T14:39:07.176916Z",
            "structure_string": "Ac1 Cd1 Ag2\n1.0\n0.000000 3.730650 3.730650\n3.730650 0.000000 3.730650\n3.730650 3.730650 0.000000\nAc Cd Ag\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ac\n0.000000 0.000000 0.000000 Cd\n0.750000 0.750000 0.750000 Ag\n0.250000 0.250000 0.250000 Ag\n",
            "nsites": 4,
            "nelements": 3,
            "elements": [
                "Ac",
                "Cd",
                "Ag"
            ],
            "chemical_system": "Ac-Ag-Cd",
            "density": 8.877156825726576,
            "density_atomic": 0.03851913057439856,
            "volume": 103.84450376609924,
            "volume_molar": 15.634155470794994,
            "formula_full": "Ac1 Cd1 Ag2",
            "formula_reduced": "AcCdAg2",
            "formula_anonymous": "ABC2",
            "energy": -11.64553392,
            "energy_per_atom": -2.91138348,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -11.64553392,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0688008,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:29.934000Z",
            "spacegroup": 225
        },
        {
            "id": "mp-1519550",
            "created_at": "2022-09-04T14:39:08.212086Z",
            "structure_string": "Sr2 Ni1 Bi1 O6\n1.0\n-0.000000 -4.081126 -4.081126\n4.081126 0.000000 -4.081126\n4.081126 -4.081126 0.000000\nSr Ni Bi O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Sr\n0.500000 0.500000 0.500000 Ni\n-0.000000 0.000000 -0.000000 Bi\n0.743299 0.256701 0.256701 O\n0.256701 0.743299 0.743299 O\n0.743299 0.256701 0.743299 O\n0.256701 0.743299 0.256701 O\n0.743299 0.743299 0.256701 O\n0.256701 0.256701 0.743299 O\n",
            "nsites": 10,
            "nelements": 4,
            "elements": [
                "Sr",
                "Ni",
                "Bi",
                "O"
            ],
            "chemical_system": "Bi-Ni-O-Sr",
            "density": 6.582570141036873,
            "density_atomic": 0.07355801386872292,
            "volume": 135.94711811885978,
            "volume_molar": 8.1869268122812,
            "formula_full": "Sr2 Ni1 Bi1 O6",
            "formula_reduced": "Sr2NiBiO6",
            "formula_anonymous": "ABC2D6",
            "energy": -62.281841060000005,
            "energy_per_atom": -6.2281841060000005,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -55.61884106,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 1.0000042,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:41.346000Z",
            "spacegroup": 225
        },
        {
            "id": "mp-1226301",
            "created_at": "2022-09-04T14:39:08.214484Z",
            "structure_string": "Eu4 Mn2 Ge8 O24\n1.0\n7.178617 -7.197351 0.000000\n7.178617 7.197351 0.000000\n0.000000 0.000000 5.033748\nEu Mn Ge O\n4 2 8 24\ndirect\n0.000000 0.500000 0.500000 Eu\n0.500000 0.000000 0.500000 Eu\n0.750000 0.750000 0.500000 Eu\n0.250000 0.250000 0.500000 Eu\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.500000 Mn\n0.743925 0.473453 0.992382 Ge\n0.256075 0.526547 0.007618 Ge\n0.243925 0.973453 0.007618 Ge\n0.756075 0.026547 0.992382 Ge\n0.473453 0.743925 0.007618 Ge\n0.526547 0.256075 0.992382 Ge\n0.973453 0.243925 0.992382 Ge\n0.026547 0.756075 0.007618 Ge\n0.549849 0.659005 0.272277 O\n0.065387 0.324071 0.235951 O\n0.434613 0.175929 0.235951 O\n0.950151 0.840995 0.272277 O\n0.450151 0.340995 0.727723 O\n0.934613 0.675929 0.764049 O\n0.565387 0.824071 0.764049 O\n0.049849 0.159005 0.727723 O\n0.659005 0.549849 0.727723 O\n0.324071 0.065387 0.764049 O\n0.175929 0.434613 0.764049 O\n0.840995 0.950151 0.727723 O\n0.340995 0.450151 0.272277 O\n0.675929 0.934613 0.235951 O\n0.824071 0.565387 0.235951 O\n0.159005 0.049849 0.272277 O\n0.369751 0.630249 0.827749 O\n0.868164 0.368164 0.835194 O\n0.631836 0.131836 0.835194 O\n0.130249 0.869751 0.827749 O\n0.630249 0.369751 0.172251 O\n0.131836 0.631836 0.164806 O\n0.368164 0.868164 0.164806 O\n0.869751 0.130249 0.172251 O\n",
            "nsites": 38,
            "nelements": 4,
            "elements": [
                "Eu",
                "Mn",
                "Ge",
                "O"
            ],
            "chemical_system": "Eu-Ge-Mn-O",
            "density": 5.372252244756965,
            "density_atomic": 0.07305478466189119,
            "volume": 520.1575800390058,
            "volume_molar": 8.24332148519963,
            "formula_full": "Eu4 Mn2 Ge8 O24",
            "formula_reduced": "Eu2Mn(GeO3)4",
            "formula_anonymous": "AB2C4D12",
            "energy": -308.07210053,
            "energy_per_atom": -8.107160540263157,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -288.24810053,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 34.0000003,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:25.266000Z",
            "spacegroup": 67
        },
        {
            "id": "mp-1183442",
            "created_at": "2022-09-04T14:39:08.220450Z",
            "structure_string": "Bi1 Pd2 Au1\n1.0\n0.000000 3.348941 3.348941\n3.348941 0.000000 3.348941\n3.348941 3.348941 0.000000\nBi Pd Au\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Bi\n0.250000 0.250000 0.250000 Pd\n0.750000 0.750000 0.750000 Pd\n0.500000 0.500000 0.500000 Au\n",
            "nsites": 4,
            "nelements": 3,
            "elements": [
                "Bi",
                "Pd",
                "Au"
            ],
            "chemical_system": "Au-Bi-Pd",
            "density": 13.678477862075646,
            "density_atomic": 0.053248515707789566,
            "volume": 75.1194647743928,
            "volume_molar": 11.309499767181377,
            "formula_full": "Bi1 Pd2 Au1",
            "formula_reduced": "BiPd2Au",
            "formula_anonymous": "ABC2",
            "energy": -18.38003676,
            "energy_per_atom": -4.59500919,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -18.38003676,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 5.72e-05,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:29.029000Z",
            "spacegroup": 225
        },
        {
            "id": "mp-1218990",
            "created_at": "2022-09-04T14:39:08.553453Z",
            "structure_string": "Sm1 Y4 Se5\n1.0\n16.693003 -2.062771 0.000000\n16.693003 2.062771 0.000000\n16.438105 0.000000 3.563720\nSm Y Se\n1 4 5\ndirect\n0.000000 0.000000 0.000000 Sm\n0.599772 0.599772 0.599772 Y\n0.200043 0.200043 0.200043 Y\n0.799957 0.799957 0.799957 Y\n0.400228 0.400228 0.400228 Y\n0.701341 0.701341 0.701341 Se\n0.100107 0.100107 0.100107 Se\n0.500000 0.500000 0.500000 Se\n0.298659 0.298659 0.298659 Se\n0.899893 0.899893 0.899893 Se\n",
            "nsites": 10,
            "nelements": 3,
            "elements": [
                "Sm",
                "Y",
                "Se"
            ],
            "chemical_system": "Se-Sm-Y",
            "density": 6.0946730546354875,
            "density_atomic": 0.04074562101597103,
            "volume": 245.42514632628394,
            "volume_molar": 14.779847772204787,
            "formula_full": "Sm1 Y4 Se5",
            "formula_reduced": "SmY4Se5",
            "formula_anonymous": "AB4C5",
            "energy": -68.12202916,
            "energy_per_atom": -6.8122029159999995,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -65.76202916,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0045557,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:37.573000Z",
            "spacegroup": 166
        },
        {
            "id": "mp-1804",
            "created_at": "2022-09-04T14:39:07.163603Z",
            "structure_string": "Fe6 N2\n1.0\n2.329385 -4.034613 0.000000\n2.329385 4.034613 0.000000\n0.000000 0.000000 4.322224\nFe N\n6 2\ndirect\n0.673179 0.673179 0.000000 Fe\n0.000000 0.673179 0.500000 Fe\n0.673179 0.000000 0.500000 Fe\n0.326821 0.326821 0.500000 Fe\n0.000000 0.326821 0.000000 Fe\n0.326821 0.000000 0.000000 Fe\n0.666667 0.333333 0.250000 N\n0.333333 0.666667 0.750000 N\n",
            "nsites": 8,
            "nelements": 2,
            "elements": [
                "Fe",
                "N"
            ],
            "chemical_system": "Fe-N",
            "density": 7.421215908097189,
            "density_atomic": 0.09847127535845915,
            "volume": 81.24196595279257,
            "volume_molar": 6.115631932335554,
            "formula_full": "Fe6 N2",
            "formula_reduced": "Fe3N",
            "formula_anonymous": "AB3",
            "energy": -68.75887598999999,
            "energy_per_atom": -8.594859498749999,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -68.03687599,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 12.3569911,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:23.868000Z",
            "spacegroup": 182
        },
        {
            "id": "mp-1197290",
            "created_at": "2022-09-04T14:39:08.210018Z",
            "structure_string": "Tb12 Ga20\n1.0\n6.137740 0.000000 0.000000\n0.000000 9.735035 0.000000\n0.000000 0.000000 11.499997\nTb Ga\n12 20\ndirect\n0.848879 0.750000 0.073614 Tb\n0.651121 0.750000 0.573614 Tb\n0.151121 0.250000 0.926386 Tb\n0.348879 0.250000 0.426386 Tb\n0.889548 0.509210 0.351959 Tb\n0.610452 0.990790 0.851959 Tb\n0.110452 0.009210 0.648041 Tb\n0.389548 0.490790 0.148041 Tb\n0.110452 0.490790 0.648041 Tb\n0.389548 0.009210 0.148041 Tb\n0.889548 0.990790 0.351959 Tb\n0.610452 0.509210 0.851959 Tb\n0.874811 0.053251 0.090916 Ga\n0.625189 0.446749 0.590916 Ga\n0.125189 0.553251 0.909084 Ga\n0.374811 0.946749 0.409084 Ga\n0.125189 0.946749 0.909084 Ga\n0.374811 0.553251 0.409084 Ga\n0.874811 0.446749 0.090916 Ga\n0.625189 0.053251 0.590916 Ga\n0.175971 0.750000 0.252093 Ga\n0.324029 0.750000 0.752093 Ga\n0.824029 0.250000 0.747907 Ga\n0.675971 0.250000 0.247907 Ga\n0.370467 0.750000 0.004820 Ga\n0.129533 0.750000 0.504820 Ga\n0.629533 0.250000 0.995180 Ga\n0.870467 0.250000 0.495180 Ga\n0.602102 0.750000 0.298829 Ga\n0.897898 0.750000 0.798829 Ga\n0.397898 0.250000 0.701171 Ga\n0.102102 0.250000 0.201171 Ga\n",
            "nsites": 32,
            "nelements": 2,
            "elements": [
                "Tb",
                "Ga"
            ],
            "chemical_system": "Ga-Tb",
            "density": 7.9785709693421305,
            "density_atomic": 0.04657000092999055,
            "volume": 687.1376285370088,
            "volume_molar": 12.93137350169519,
            "formula_full": "Tb12 Ga20",
            "formula_reduced": "Tb3Ga5",
            "formula_anonymous": "A3B5",
            "energy": -137.38248869,
            "energy_per_atom": -4.2932027715625,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -137.38248869,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0068722,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:45.854000Z",
            "spacegroup": 62
        },
        {
            "id": "mp-5792",
            "created_at": "2022-09-04T14:39:06.677776Z",
            "structure_string": "Ba2 Cu2 Sn4\n1.0\n2.431548 -9.810407 0.000000\n2.431548 9.810407 0.000000\n0.000000 0.000000 4.691833\nBa Cu Sn\n2 2 4\ndirect\n0.391907 0.608093 0.250000 Ba\n0.608093 0.391907 0.750000 Ba\n0.820873 0.179127 0.750000 Cu\n0.179127 0.820873 0.250000 Cu\n0.043340 0.956660 0.250000 Sn\n0.956660 0.043340 0.750000 Sn\n0.250059 0.749941 0.750000 Sn\n0.749941 0.250059 0.250000 Sn\n",
            "nsites": 8,
            "nelements": 3,
            "elements": [
                "Ba",
                "Cu",
                "Sn"
            ],
            "chemical_system": "Ba-Cu-Sn",
            "density": 6.502812234831334,
            "density_atomic": 0.03573942602554695,
            "volume": 223.8424308851941,
            "volume_molar": 16.85013283564013,
            "formula_full": "Ba2 Cu2 Sn4",
            "formula_reduced": "BaCuSn2",
            "formula_anonymous": "ABC2",
            "energy": -31.68637911,
            "energy_per_atom": -3.96079738875,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -31.68637911,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0029663,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:29.557000Z",
            "spacegroup": 63
        },
        {
            "id": "mp-1189034",
            "created_at": "2022-09-04T14:39:08.228952Z",
            "structure_string": "Cs2 Te4 O12\n1.0\n0.000000 5.274826 5.274826\n5.274826 0.000000 5.274826\n5.274826 5.274826 0.000000\nCs Te O\n2 4 12\ndirect\n0.500000 0.500000 0.500000 Cs\n0.750000 0.750000 0.750000 Cs\n0.625000 0.125000 0.125000 Te\n0.125000 0.625000 0.125000 Te\n0.125000 0.125000 0.625000 Te\n0.125000 0.125000 0.125000 Te\n0.806687 0.193313 0.193313 O\n0.193313 0.806687 0.806687 O\n0.193313 0.193313 0.806687 O\n0.806687 0.806687 0.193313 O\n0.193313 0.806687 0.193313 O\n0.806687 0.193313 0.806687 O\n0.443313 0.056687 0.056687 O\n0.056687 0.443313 0.443313 O\n0.056687 0.056687 0.443313 O\n0.443313 0.443313 0.056687 O\n0.056687 0.443313 0.056687 O\n0.443313 0.056687 0.443313 O\n",
            "nsites": 18,
            "nelements": 3,
            "elements": [
                "Cs",
                "Te",
                "O"
            ],
            "chemical_system": "Cs-O-Te",
            "density": 5.477235658721388,
            "density_atomic": 0.061322251908368076,
            "volume": 293.53129475572484,
            "volume_molar": 9.820482080466805,
            "formula_full": "Cs2 Te4 O12",
            "formula_reduced": "Cs(TeO3)2",
            "formula_anonymous": "AB2C6",
            "energy": -103.35908736,
            "energy_per_atom": -5.74217152,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -95.11508736,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0011037,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:34.448000Z",
            "spacegroup": 227
        },
        {
            "id": "mp-1103053",
            "created_at": "2022-09-04T14:39:12.587960Z",
            "structure_string": "Er3 Cu4 Sn4\n1.0\n2.226675 8.081952 0.000000\n-2.226675 8.081952 0.000000\n0.000000 2.932425 6.285336\nEr Cu Sn\n3 4 4\ndirect\n0.000000 0.000000 0.000000 Er\n0.130223 0.130223 0.360042 Er\n0.869777 0.869777 0.639958 Er\n0.337115 0.337115 0.979757 Cu\n0.662885 0.662885 0.020243 Cu\n0.321125 0.321125 0.369023 Cu\n0.678875 0.678875 0.630977 Cu\n0.217437 0.217437 0.793716 Sn\n0.782563 0.782563 0.206284 Sn\n0.506618 0.506618 0.696522 Sn\n0.493382 0.493382 0.303478 Sn\n",
            "nsites": 11,
            "nelements": 3,
            "elements": [
                "Er",
                "Cu",
                "Sn"
            ],
            "chemical_system": "Cu-Er-Sn",
            "density": 9.034525401693852,
            "density_atomic": 0.048625165283711726,
            "volume": 226.22031073454755,
            "volume_molar": 12.384823218312587,
            "formula_full": "Er3 Cu4 Sn4",
            "formula_reduced": "Er3(CuSn)4",
            "formula_anonymous": "A3B4C4",
            "energy": -51.48873405999999,
            "energy_per_atom": -4.680794005454545,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -51.48873405999999,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0099603,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:27.836000Z",
            "spacegroup": 12
        }
    ]
}