GET /third-parties/MatprojStructure/?format=api&ordering=-is_magnetic&page=11457
HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept

{
    "count": 146323,
    "next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-is_magnetic&page=11458",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-is_magnetic&page=11456",
    "results": [
        {
            "id": "mp-27554",
            "created_at": "2022-09-04T14:45:11.732273Z",
            "structure_string": "Ag24 Au8 S16\n1.0\n9.874385 0.000000 0.000000\n0.000000 9.874385 0.000000\n0.000000 0.000000 9.874385\nAg Au S\n24 8 16\ndirect\n0.251497 0.384222 0.000940 Ag\n0.499060 0.748503 0.884222 Ag\n0.751497 0.115778 0.999060 Ag\n0.000940 0.251497 0.384222 Ag\n0.248503 0.615778 0.500940 Ag\n0.748503 0.884222 0.499060 Ag\n0.500940 0.248503 0.615778 Ag\n0.884222 0.499060 0.748503 Ag\n0.615778 0.500940 0.248503 Ag\n0.115778 0.999060 0.751497 Ag\n0.750940 0.634222 0.998503 Ag\n0.749060 0.365778 0.498503 Ag\n0.501497 0.249060 0.134222 Ag\n0.498503 0.749060 0.365778 Ag\n0.865778 0.001497 0.250940 Ag\n0.365778 0.498503 0.749060 Ag\n0.249060 0.134222 0.501497 Ag\n0.998503 0.750940 0.634222 Ag\n0.001497 0.250940 0.865778 Ag\n0.134222 0.501497 0.249060 Ag\n0.634222 0.998503 0.750940 Ag\n0.384222 0.000940 0.251497 Ag\n0.999060 0.751497 0.115778 Ag\n0.250940 0.865778 0.001497 Ag\n0.622056 0.622056 0.622056 Au\n0.872056 0.627944 0.372056 Au\n0.627944 0.372056 0.872056 Au\n0.372056 0.872056 0.627944 Au\n0.122056 0.877944 0.377944 Au\n0.877944 0.377944 0.122056 Au\n0.377944 0.122056 0.877944 Au\n0.127944 0.127944 0.127944 Au\n0.760829 0.760829 0.760829 S\n0.010829 0.489171 0.510829 S\n0.489171 0.510829 0.010829 S\n0.510829 0.010829 0.489171 S\n0.260829 0.739171 0.239171 S\n0.739171 0.239171 0.260829 S\n0.239171 0.260829 0.739171 S\n0.989171 0.989171 0.989171 S\n0.766471 0.233529 0.733529 S\n0.233529 0.733529 0.766471 S\n0.983529 0.016471 0.516471 S\n0.016471 0.516471 0.983529 S\n0.516471 0.983529 0.016471 S\n0.266471 0.266471 0.266471 S\n0.483529 0.483529 0.483529 S\n0.733529 0.766471 0.233529 S\n",
            "nsites": 48,
            "nelements": 3,
            "elements": [
                "Ag",
                "Au",
                "S"
            ],
            "chemical_system": "Ag-Au-S",
            "density": 8.067572516653907,
            "density_atomic": 0.04985526954223026,
            "volume": 962.7868917515582,
            "volume_molar": 12.079246216689098,
            "formula_full": "Ag24 Au8 S16",
            "formula_reduced": "Ag3AuS2",
            "formula_anonymous": "AB2C3",
            "energy": -170.31218524,
            "energy_per_atom": -3.548170525833333,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -162.26418524,
            "band_gap": 0.2442999999999999,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0002168,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:52.554000Z",
            "spacegroup": 213
        },
        {
            "id": "mp-30299",
            "created_at": "2022-09-04T14:45:11.772733Z",
            "structure_string": "Rb4 As4 O8\n1.0\n5.610034 0.000000 0.000000\n0.000000 7.661310 0.000000\n0.000000 0.000000 7.934630\nRb As O\n4 4 8\ndirect\n0.250000 0.359082 0.402031 Rb\n0.750000 0.640918 0.597969 Rb\n0.750000 0.359082 0.097969 Rb\n0.250000 0.640918 0.902031 Rb\n0.250000 0.846221 0.365314 As\n0.750000 0.846221 0.134686 As\n0.750000 0.153779 0.634686 As\n0.250000 0.153779 0.865314 As\n0.500000 0.268790 0.750000 O\n0.000000 0.731210 0.250000 O\n0.500000 0.731210 0.250000 O\n0.000000 0.268790 0.750000 O\n0.250000 0.719795 0.544432 O\n0.250000 0.280205 0.044432 O\n0.750000 0.719795 0.955568 O\n0.750000 0.280205 0.455568 O\n",
            "nsites": 16,
            "nelements": 3,
            "elements": [
                "Rb",
                "As",
                "O"
            ],
            "chemical_system": "As-O-Rb",
            "density": 3.7470743565966957,
            "density_atomic": 0.04691641009461051,
            "volume": 341.0320603757786,
            "volume_molar": 12.835894195348482,
            "formula_full": "Rb4 As4 O8",
            "formula_reduced": "RbAsO2",
            "formula_anonymous": "ABC2",
            "energy": -91.99749581,
            "energy_per_atom": -5.749843488125,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -86.50149581,
            "band_gap": 3.8821,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 3.9e-06,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:53.213000Z",
            "spacegroup": 57
        },
        {
            "id": "mp-1188032",
            "created_at": "2022-09-04T14:45:11.792582Z",
            "structure_string": "Zr6 Cl2\n1.0\n3.053650 -5.289077 0.000000\n3.053650 5.289077 0.000000\n0.000000 0.000000 5.389189\nZr Cl\n6 2\ndirect\n0.162195 0.324390 0.250000 Zr\n0.675610 0.837805 0.250000 Zr\n0.162195 0.837805 0.250000 Zr\n0.837805 0.675610 0.750000 Zr\n0.324390 0.162195 0.750000 Zr\n0.837805 0.162195 0.750000 Zr\n0.333333 0.666667 0.750000 Cl\n0.666667 0.333333 0.250000 Cl\n",
            "nsites": 8,
            "nelements": 2,
            "elements": [
                "Zr",
                "Cl"
            ],
            "chemical_system": "Cl-Zr",
            "density": 5.89740107265786,
            "density_atomic": 0.04595549294297625,
            "volume": 174.08147508996973,
            "volume_molar": 13.104289333752892,
            "formula_full": "Zr6 Cl2",
            "formula_reduced": "Zr3Cl",
            "formula_anonymous": "AB3",
            "energy": -54.54667601,
            "energy_per_atom": -6.81833450125,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -53.31867601,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0039795,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:52.225000Z",
            "spacegroup": 194
        },
        {
            "id": "mp-9961",
            "created_at": "2022-09-04T14:45:12.255235Z",
            "structure_string": "Ti4 Cd2 C2\n1.0\n1.552556 -2.689106 0.000000\n1.552556 2.689106 0.000000\n0.000000 0.000000 14.543701\nTi Cd C\n4 2 2\ndirect\n0.666667 0.333333 0.577465 Ti\n0.333333 0.666667 0.422535 Ti\n0.333333 0.666667 0.077465 Ti\n0.666667 0.333333 0.922535 Ti\n0.666667 0.333333 0.250000 Cd\n0.333333 0.666667 0.750000 Cd\n0.000000 0.000000 0.500000 C\n0.000000 0.000000 0.000000 C\n",
            "nsites": 8,
            "nelements": 3,
            "elements": [
                "Ti",
                "Cd",
                "C"
            ],
            "chemical_system": "C-Cd-Ti",
            "density": 6.02072649069647,
            "density_atomic": 0.0658764000513543,
            "volume": 121.43954426416073,
            "volume_molar": 9.141575367362831,
            "formula_full": "Ti4 Cd2 C2",
            "formula_reduced": "Ti2CdC",
            "formula_anonymous": "ABC2",
            "energy": -56.17632461,
            "energy_per_atom": -7.02204057625,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -56.17632461,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0038838,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:53.184000Z",
            "spacegroup": 194
        },
        {
            "id": "mp-1226783",
            "created_at": "2022-09-04T14:45:17.322329Z",
            "structure_string": "Cd4 Te3 Se1\n1.0\n4.615237 0.000000 0.000000\n0.000000 6.481166 0.000000\n0.000000 0.000000 9.263386\nCd Te Se\n4 3 1\ndirect\n0.000000 0.020497 0.000000 Cd\n0.500000 0.491490 0.762055 Cd\n0.000000 0.995011 0.500000 Cd\n0.500000 0.491490 0.237945 Cd\n0.000000 0.750236 0.756416 Te\n0.500000 0.253141 0.500000 Te\n0.000000 0.750236 0.243584 Te\n0.500000 0.247898 0.000000 Se\n",
            "nsites": 8,
            "nelements": 3,
            "elements": [
                "Cd",
                "Te",
                "Se"
            ],
            "chemical_system": "Cd-Se-Te",
            "density": 5.4618920678809655,
            "density_atomic": 0.028871747642163974,
            "volume": 277.0874870185167,
            "volume_molar": 20.858248120752254,
            "formula_full": "Cd4 Te3 Se1",
            "formula_reduced": "Cd4Te3Se",
            "formula_anonymous": "AB3C4",
            "energy": -22.27388488,
            "energy_per_atom": -2.78423561,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -20.53588488,
            "band_gap": 0.6374,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0032146,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:09.114000Z",
            "spacegroup": 25
        },
        {
            "id": "mp-29736",
            "created_at": "2022-09-04T14:45:09.310943Z",
            "structure_string": "Y2 Al2 Ge2\n1.0\n2.036596 -5.236052 0.000000\n2.036596 5.236052 0.000000\n0.000000 0.000000 5.786273\nY Al Ge\n2 2 2\ndirect\n0.310256 0.689744 0.250000 Y\n0.689744 0.310256 0.750000 Y\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.394401 0.605599 0.750000 Ge\n0.605599 0.394401 0.250000 Ge\n",
            "nsites": 6,
            "nelements": 3,
            "elements": [
                "Y",
                "Al",
                "Ge"
            ],
            "chemical_system": "Al-Ge-Y",
            "density": 5.073594944041729,
            "density_atomic": 0.04861983685717227,
            "volume": 123.40641984517264,
            "volume_molar": 12.386180516588116,
            "formula_full": "Y2 Al2 Ge2",
            "formula_reduced": "YAlGe",
            "formula_anonymous": "ABC",
            "energy": -33.66076413,
            "energy_per_atom": -5.6101273549999995,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -33.66076413,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 7.47e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:51.027000Z",
            "spacegroup": 63
        },
        {
            "id": "mp-976291",
            "created_at": "2022-09-04T14:45:10.901970Z",
            "structure_string": "Li2 Al2 H8\n1.0\n-2.287878 2.287878 5.109060\n2.287878 -2.287878 5.109060\n2.287878 2.287878 -5.109060\nLi Al H\n2 2 8\ndirect\n0.250000 0.750000 0.500000 Li\n0.500000 0.500000 0.000000 Li\n0.750000 0.250000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.580442 0.507647 0.420032 H\n0.087615 0.160410 0.579968 H\n0.910410 0.830442 0.572795 H\n0.257647 0.337615 0.427205 H\n0.169558 0.742353 0.079968 H\n0.662385 0.089590 0.920032 H\n0.839590 0.419558 0.927205 H\n0.492353 0.912385 0.072795 H\n",
            "nsites": 12,
            "nelements": 3,
            "elements": [
                "Li",
                "Al",
                "H"
            ],
            "chemical_system": "Al-H-Li",
            "density": 1.1783473906400899,
            "density_atomic": 0.11217976537285734,
            "volume": 106.97116329415573,
            "volume_molar": 5.368295021819592,
            "formula_full": "Li2 Al2 H8",
            "formula_reduced": "LiAlH4",
            "formula_anonymous": "ABC4",
            "energy": -41.46556746,
            "energy_per_atom": -3.4554639550000004,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -40.03356746,
            "band_gap": 3.9597,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 7.1e-06,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:50.294000Z",
            "spacegroup": 88
        },
        {
            "id": "mp-541146",
            "created_at": "2022-09-04T14:45:11.871635Z",
            "structure_string": "Ge8 C8 Se12 F24\n1.0\n0.000000 8.221507 8.221507\n8.221507 0.000000 8.221507\n8.221507 8.221507 0.000000\nGe C Se F\n8 8 12 24\ndirect\n0.826948 0.826948 0.826948 Ge\n0.730843 0.423052 0.423052 Ge\n0.423052 0.730843 0.423052 Ge\n0.423052 0.423052 0.730843 Ge\n0.826948 0.519157 0.826948 Ge\n0.826948 0.826948 0.519157 Ge\n0.519157 0.826948 0.826948 Ge\n0.423052 0.423052 0.423052 Ge\n0.899132 0.899132 0.899132 C\n0.947396 0.350868 0.350868 C\n0.350868 0.947396 0.350868 C\n0.350868 0.350868 0.947396 C\n0.899132 0.302604 0.899132 C\n0.899132 0.899132 0.302604 C\n0.302604 0.899132 0.899132 C\n0.350868 0.350868 0.350868 C\n0.922654 0.577346 0.922654 Se\n0.672654 0.327346 0.327346 Se\n0.327346 0.672654 0.672654 Se\n0.672654 0.327346 0.672654 Se\n0.327346 0.327346 0.672654 Se\n0.672654 0.672654 0.327346 Se\n0.922654 0.922654 0.577346 Se\n0.577346 0.922654 0.922654 Se\n0.922654 0.577346 0.577346 Se\n0.577346 0.577346 0.922654 Se\n0.327346 0.672654 0.327346 Se\n0.577346 0.922654 0.577346 Se\n0.790468 0.979625 0.979625 F\n0.999718 0.270375 0.459532 F\n0.270375 0.999718 0.270375 F\n0.270375 0.270375 0.999718 F\n0.999718 0.459532 0.270375 F\n0.270375 0.459532 0.999718 F\n0.270375 0.999718 0.459532 F\n0.979625 0.790468 0.979625 F\n0.979625 0.979625 0.790468 F\n0.790468 0.250282 0.979625 F\n0.790468 0.979625 0.250282 F\n0.979625 0.250282 0.979625 F\n0.250282 0.790468 0.979625 F\n0.250282 0.979625 0.790468 F\n0.979625 0.979625 0.250282 F\n0.459532 0.999718 0.270375 F\n0.459532 0.270375 0.999718 F\n0.999718 0.270375 0.270375 F\n0.459532 0.270375 0.270375 F\n0.270375 0.459532 0.270375 F\n0.270375 0.270375 0.459532 F\n0.979625 0.790468 0.250282 F\n0.979625 0.250282 0.790468 F\n0.250282 0.979625 0.979625 F\n",
            "nsites": 52,
            "nelements": 4,
            "elements": [
                "Ge",
                "C",
                "Se",
                "F"
            ],
            "chemical_system": "C-F-Ge-Se",
            "density": 3.1086485156899037,
            "density_atomic": 0.04678633813947085,
            "volume": 1111.4355614877818,
            "volume_molar": 12.871579609517417,
            "formula_full": "Ge8 C8 Se12 F24",
            "formula_reduced": "Ge2C2(SeF2)3",
            "formula_anonymous": "A2B2C3D6",
            "energy": -269.12060667,
            "energy_per_atom": -5.1753962821153845,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -252.36860667,
            "band_gap": 2.3058,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 7.29e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:55.259000Z",
            "spacegroup": 227
        },
        {
            "id": "mp-1173335",
            "created_at": "2022-09-04T14:45:11.888614Z",
            "structure_string": "Sb2 S2 I4\n1.0\n5.523541 0.000000 0.000000\n0.000000 12.343028 0.000000\n0.000000 0.000000 6.394551\nSb S I\n2 2 4\ndirect\n0.750000 0.296720 0.170951 Sb\n0.750000 0.796720 0.329049 Sb\n0.750000 0.631988 0.146889 S\n0.750000 0.131988 0.353111 S\n0.250000 0.886633 0.252244 I\n0.250000 0.386633 0.247756 I\n0.750000 0.719440 0.751561 I\n0.750000 0.219440 0.748439 I\n",
            "nsites": 8,
            "nelements": 3,
            "elements": [
                "Sb",
                "S",
                "I"
            ],
            "chemical_system": "I-S-Sb",
            "density": 3.1052750800566176,
            "density_atomic": 0.01835019295702775,
            "volume": 435.96271814330777,
            "volume_molar": 32.81786068464007,
            "formula_full": "Sb2 S2 I4",
            "formula_reduced": "SbSI2",
            "formula_anonymous": "ABC2",
            "energy": -25.373684410000003,
            "energy_per_atom": -3.1717105512500003,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -22.85168441,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0004672,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:52.089000Z",
            "spacegroup": 26
        },
        {
            "id": "mp-1200224",
            "created_at": "2022-09-04T14:45:09.434262Z",
            "structure_string": "Cs12 P12 S12 O24\n1.0\n8.536396 0.000000 0.000000\n0.000000 13.216813 0.000000\n0.000000 0.347024 13.656569\nCs P S O\n12 12 12 24\ndirect\n0.277968 0.836978 0.033653 Cs\n0.777968 0.663022 0.966347 Cs\n0.722032 0.163022 0.966347 Cs\n0.222032 0.336978 0.033653 Cs\n0.788684 0.181558 0.576065 Cs\n0.288684 0.318442 0.423935 Cs\n0.211316 0.818442 0.423935 Cs\n0.711316 0.681558 0.576065 Cs\n0.498883 0.401787 0.744697 Cs\n0.998883 0.098213 0.255303 Cs\n0.501117 0.598213 0.255303 Cs\n0.001117 0.901787 0.744697 Cs\n0.309012 0.120404 0.850645 P\n0.809012 0.379596 0.149355 P\n0.690988 0.879596 0.149355 P\n0.190988 0.620404 0.850645 P\n0.547596 0.982402 0.760529 P\n0.047596 0.517598 0.239471 P\n0.452404 0.017598 0.239471 P\n0.952404 0.482402 0.760529 P\n0.833626 0.390225 0.364571 P\n0.333626 0.109775 0.635429 P\n0.166374 0.609775 0.635429 P\n0.666374 0.890225 0.364571 P\n0.361043 0.580178 0.940625 S\n0.861043 0.919822 0.059375 S\n0.638957 0.419822 0.059375 S\n0.138957 0.080178 0.940625 S\n0.678463 0.432267 0.462399 S\n0.178463 0.067733 0.537601 S\n0.321537 0.567733 0.537601 S\n0.821537 0.932267 0.462399 S\n0.550072 0.834374 0.775921 S\n0.050072 0.665626 0.224079 S\n0.449928 0.165626 0.224079 S\n0.949928 0.334374 0.775921 S\n0.762458 0.880783 0.260764 O\n0.262458 0.619217 0.739236 O\n0.237542 0.119217 0.739236 O\n0.737542 0.380783 0.260764 O\n0.568194 0.975211 0.152639 O\n0.068194 0.524789 0.847361 O\n0.431806 0.024789 0.847361 O\n0.931806 0.475211 0.152639 O\n0.398208 0.216387 0.868146 O\n0.898208 0.283613 0.131854 O\n0.601792 0.783613 0.131854 O\n0.101792 0.716387 0.868146 O\n0.555327 0.988163 0.338204 O\n0.055327 0.511837 0.661796 O\n0.444673 0.011837 0.661796 O\n0.944673 0.488163 0.338204 O\n0.697562 0.041684 0.759621 O\n0.197562 0.458316 0.240379 O\n0.302438 0.958316 0.240379 O\n0.802438 0.541684 0.759621 O\n0.930765 0.297238 0.385090 O\n0.430765 0.202762 0.614910 O\n0.069235 0.702762 0.614910 O\n0.569235 0.797238 0.385090 O\n",
            "nsites": 60,
            "nelements": 4,
            "elements": [
                "Cs",
                "P",
                "S",
                "O"
            ],
            "chemical_system": "Cs-O-P-S",
            "density": 2.9479066545643238,
            "density_atomic": 0.03894111191108983,
            "volume": 1540.788052919283,
            "volume_molar": 15.46473756001042,
            "formula_full": "Cs12 P12 S12 O24",
            "formula_reduced": "CsPSO2",
            "formula_anonymous": "ABCD2",
            "energy": -370.90889378,
            "energy_per_atom": -6.181814896333334,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -348.38489378,
            "band_gap": 4.075799999999999,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.000429,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:47.409000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-510539",
            "created_at": "2022-09-04T14:45:09.474695Z",
            "structure_string": "Dy6 Cu2 Sn2 Se14\n1.0\n5.112682 -8.855425 0.000000\n5.112682 8.855425 0.000000\n0.000000 0.000000 6.519289\nDy Cu Sn Se\n6 2 2 14\ndirect\n0.357548 0.154422 0.393210 Dy\n0.203126 0.357548 0.893210 Dy\n0.154422 0.796874 0.893210 Dy\n0.845578 0.203126 0.393210 Dy\n0.796874 0.642452 0.393210 Dy\n0.642452 0.845578 0.893210 Dy\n0.000000 0.000000 0.999256 Cu\n0.000000 0.000000 0.499256 Cu\n0.333333 0.666667 0.321852 Sn\n0.666667 0.333333 0.821852 Sn\n0.265209 0.118792 0.968578 Se\n0.146417 0.265209 0.468578 Se\n0.118792 0.853583 0.468578 Se\n0.881208 0.146417 0.968578 Se\n0.853583 0.734791 0.968578 Se\n0.734791 0.881208 0.468578 Se\n0.520089 0.442049 0.638576 Se\n0.078040 0.520089 0.138576 Se\n0.442049 0.921960 0.138576 Se\n0.557951 0.078040 0.638576 Se\n0.921960 0.479911 0.638576 Se\n0.479911 0.557951 0.138576 Se\n0.333333 0.666667 0.714201 Se\n0.666667 0.333333 0.214201 Se\n",
            "nsites": 24,
            "nelements": 4,
            "elements": [
                "Dy",
                "Cu",
                "Sn",
                "Se"
            ],
            "chemical_system": "Cu-Dy-Se-Sn",
            "density": 6.877506587066905,
            "density_atomic": 0.04065582908077413,
            "volume": 590.3212538678603,
            "volume_molar": 14.812490351716455,
            "formula_full": "Dy6 Cu2 Sn2 Se14",
            "formula_reduced": "Dy3CuSnSe7",
            "formula_anonymous": "ABC3D7",
            "energy": -129.59928367,
            "energy_per_atom": -5.399970152916667,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -122.99128367,
            "band_gap": 0.9926000000000004,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0023208,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:47.761000Z",
            "spacegroup": 173
        },
        {
            "id": "mp-1228564",
            "created_at": "2022-09-04T14:45:09.435395Z",
            "structure_string": "Ba4 Si6 Ge2 O20\n1.0\n4.741067 -0.000663 0.000000\n-0.001710 7.873975 0.000000\n0.000000 0.000000 13.854946\nBa Si Ge O\n4 6 2 20\ndirect\n0.214877 0.250610 0.544769 Ba\n0.285123 0.249390 0.044769 Ba\n0.779608 0.755273 0.457232 Ba\n0.720392 0.744727 0.957232 Ba\n0.853742 0.550269 0.180330 Si\n0.646258 0.949731 0.680330 Si\n0.854729 0.953742 0.183170 Si\n0.645271 0.546258 0.683170 Si\n0.144983 0.458574 0.816530 Si\n0.355017 0.041426 0.316530 Si\n0.149537 0.043701 0.817387 Ge\n0.350463 0.456299 0.317387 Ge\n0.345285 0.046768 0.707760 O\n0.154715 0.453232 0.207760 O\n0.675460 0.553232 0.283169 O\n0.824540 0.946768 0.783169 O\n0.652749 0.950668 0.280736 O\n0.847251 0.549332 0.780736 O\n0.346598 0.456145 0.718950 O\n0.153402 0.043855 0.218950 O\n0.267639 0.953085 0.921762 O\n0.232361 0.546915 0.421762 O\n0.727695 0.462403 0.086240 O\n0.772305 0.037597 0.586240 O\n0.740119 0.044696 0.088434 O\n0.759881 0.455304 0.588434 O\n0.261593 0.548768 0.911485 O\n0.238407 0.951232 0.411485 O\n0.067496 0.259297 0.844520 O\n0.432504 0.240703 0.344520 O\n0.925095 0.752207 0.157526 O\n0.574905 0.747793 0.657526 O\n",
            "nsites": 32,
            "nelements": 4,
            "elements": [
                "Ba",
                "Si",
                "Ge",
                "O"
            ],
            "chemical_system": "Ba-Ge-O-Si",
            "density": 3.7983201316752155,
            "density_atomic": 0.06186927541010262,
            "volume": 517.2195696149163,
            "volume_molar": 9.733653287648892,
            "formula_full": "Ba4 Si6 Ge2 O20",
            "formula_reduced": "Ba2Si3GeO10",
            "formula_anonymous": "AB2C3D10",
            "energy": -248.79525387,
            "energy_per_atom": -7.7748516834375,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -235.05525387,
            "band_gap": 4.1604,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0034939,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:57.812000Z",
            "spacegroup": 4
        }
    ]
}