GET /third-parties/JarvisStructure/?format=api&ordering=structure_string&page=3477
HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept

{
    "count": 55712,
    "next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=structure_string&page=3478",
    "previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=structure_string&page=3476",
    "results": [
        {
            "id": "jvasp-65120",
            "created_at": "2022-09-04T14:36:11.765944Z",
            "updated_at": "2022-09-04T14:36:11.765965Z",
            "structure_string": "Sc4 Ti1 Be1\n1.0\n-0.000000 3.981215 3.981215\n3.981215 -0.000000 3.981215\n3.981215 3.981215 0.000000\nSc Ti Be\n4 1 1\ndirect\n0.127703 0.624100 0.624100 Sc\n0.624100 0.624100 0.624100 Sc\n0.624100 0.127703 0.624100 Sc\n0.624100 0.624100 0.127703 Sc\n0.250000 0.250000 0.250000 Ti\n0.000000 0.000000 0.000000 Be\n",
            "nsites": 6,
            "nelements": 3,
            "elements": [
                "Sc",
                "Ti",
                "Be"
            ],
            "chemical_system": "Be-Sc-Ti",
            "density": 3.114409081392096,
            "density_atomic": 0.04754166195354817,
            "volume": 126.20509577184023,
            "volume_molar": 12.667080856121713,
            "formula_full": "Sc4 Ti1 Be1",
            "formula_reduced": "Sc4TiBe",
            "formula_anonymous": "ABC4",
            "energy_above_hull": 3.0754275722222224,
            "spacegroup": 216
        },
        {
            "id": "jvasp-52306",
            "created_at": "2022-09-04T14:37:01.558589Z",
            "updated_at": "2022-09-04T14:37:01.558604Z",
            "structure_string": "Sc4 Ti2 O10\n1.0\n3.864336 0.000000 0.000000\n-1.932168 5.100483 0.000000\n0.000000 0.000000 10.297879\nSc Ti O\n4 2 10\ndirect\n0.362821 0.725640 0.436507 Sc\n0.305433 0.610867 0.749582 Sc\n0.694567 0.389132 0.249582 Sc\n0.637180 0.274359 0.936507 Sc\n0.366896 0.733793 0.059493 Ti\n0.633104 0.266206 0.559493 Ti\n0.446278 0.892554 0.891064 O\n0.184983 0.369964 0.569835 O\n0.270913 0.541825 0.241850 O\n0.198840 0.397679 0.932348 O\n0.462465 0.924930 0.619322 O\n0.729087 0.458174 0.741850 O\n0.815017 0.630036 0.069835 O\n0.553723 0.107445 0.391064 O\n0.537535 0.075069 0.119322 O\n0.801160 0.602321 0.432348 O\n",
            "nsites": 16,
            "nelements": 3,
            "elements": [
                "Sc",
                "Ti",
                "O"
            ],
            "chemical_system": "O-Sc-Ti",
            "density": 3.5633197009656676,
            "density_atomic": 0.07882899919877999,
            "volume": 202.97098989742884,
            "volume_molar": 7.63949919599284,
            "formula_full": "Sc4 Ti2 O10",
            "formula_reduced": "Sc2TiO5",
            "formula_anonymous": "AB2C5",
            "energy_above_hull": 2.6199095416666665,
            "spacegroup": 36
        },
        {
            "id": "jvasp-50910",
            "created_at": "2022-09-04T14:37:08.342175Z",
            "updated_at": "2022-09-04T14:37:08.342208Z",
            "structure_string": "Sc4 Ti4 O12\n1.0\n5.115429 0.000000 0.000000\n0.000000 5.505446 0.000000\n0.000000 0.000000 7.517686\nSc Ti O\n4 4 12\ndirect\n0.973456 0.925816 0.758038 Sc\n0.526544 0.425815 0.758038 Sc\n0.473456 0.574185 0.258038 Sc\n0.026544 0.074185 0.258038 Sc\n0.000005 0.499990 0.508046 Ti\n0.499995 -0.000011 0.508046 Ti\n0.500005 0.000011 0.008046 Ti\n-0.000005 0.500011 0.008046 Ti\n0.181047 0.809574 0.078635 O\n0.318971 0.309569 0.437481 O\n0.318953 0.309573 0.078635 O\n0.352253 0.066221 0.758051 O\n0.647747 0.933780 0.258051 O\n0.818953 0.190427 0.578635 O\n0.681047 0.690428 0.578635 O\n0.818971 0.190432 0.937482 O\n0.181029 0.809569 0.437481 O\n0.852254 0.433779 0.258051 O\n0.681029 0.690432 0.937482 O\n0.147747 0.566222 0.758051 O\n",
            "nsites": 20,
            "nelements": 3,
            "elements": [
                "Sc",
                "Ti",
                "O"
            ],
            "chemical_system": "O-Sc-Ti",
            "density": 4.417922648161232,
            "density_atomic": 0.09446506878603946,
            "volume": 211.71847178028736,
            "volume_molar": 6.374992192764891,
            "formula_full": "Sc4 Ti4 O12",
            "formula_reduced": "ScTiO3",
            "formula_anonymous": "ABC3",
            "energy_above_hull": 2.232000816666667,
            "spacegroup": 62
        },
        {
            "id": "jvasp-16904",
            "created_at": "2022-09-04T14:37:47.723238Z",
            "updated_at": "2022-09-04T14:37:47.723258Z",
            "structure_string": "Sc4 Tl2 C2\n1.0\n1.683864 -2.916540 0.000000\n1.683864 2.916540 0.000000\n0.000000 -0.000000 15.176672\nSc Tl C\n4 2 2\ndirect\n0.666666 0.333332 0.580370 Sc\n0.333332 0.666666 0.419630 Sc\n0.333332 0.666666 0.080370 Sc\n0.666666 0.333332 0.919630 Sc\n0.666666 0.333332 0.250000 Tl\n0.333332 0.666666 0.750000 Tl\n0.000000 0.000000 0.500000 C\n0.000000 0.000000 0.000000 C\n",
            "nsites": 8,
            "nelements": 3,
            "elements": [
                "Sc",
                "Tl",
                "C"
            ],
            "chemical_system": "C-Sc-Tl",
            "density": 6.8242174115243746,
            "density_atomic": 0.05366714521659852,
            "volume": 149.0669937391361,
            "volume_molar": 11.221280237088955,
            "formula_full": "Sc4 Tl2 C2",
            "formula_reduced": "Sc2TlC",
            "formula_anonymous": "ABC2",
            "energy_above_hull": 2.496980775,
            "spacegroup": 194
        },
        {
            "id": "jvasp-52481",
            "created_at": "2022-09-04T14:36:35.268654Z",
            "updated_at": "2022-09-04T14:36:35.268683Z",
            "structure_string": "Sc4 Tl4 O12\n1.0\n0.000000 5.529094 0.006330\n5.667863 0.000000 0.000000\n0.000000 -5.520431 -8.124312\nSc Tl O\n4 4 12\ndirect\n0.500000 0.500000 0.500000 Sc\n0.000000 0.500000 0.000000 Sc\n-0.000000 0.000000 0.500000 Sc\n0.500000 0.000000 -0.000000 Sc\n0.734950 0.950164 0.749999 Tl\n0.265049 0.450165 0.750000 Tl\n0.734950 0.549835 0.250000 Tl\n0.265049 0.049835 0.250000 Tl\n0.249103 0.811361 0.064478 O\n0.750896 0.311362 0.435522 O\n0.379860 0.311357 0.064489 O\n0.132942 0.066770 0.750003 O\n0.867057 0.933229 0.249997 O\n0.379860 0.188643 0.564489 O\n0.249103 0.688638 0.564478 O\n0.750896 0.188638 0.935521 O\n0.620139 0.811356 0.435511 O\n0.132942 0.433229 0.250003 O\n0.620139 0.688643 0.935511 O\n0.867057 0.566770 0.749997 O\n",
            "nsites": 20,
            "nelements": 3,
            "elements": [
                "Sc",
                "Tl",
                "O"
            ],
            "chemical_system": "O-Sc-Tl",
            "density": 7.763127403572157,
            "density_atomic": 0.07861547873141655,
            "volume": 254.40282655185993,
            "volume_molar": 7.66024815618583,
            "formula_full": "Sc4 Tl4 O12",
            "formula_reduced": "ScTlO3",
            "formula_anonymous": "ABC3",
            "energy_above_hull": 1.5094956699999995,
            "spacegroup": 62
        },
        {
            "id": "jvasp-97355",
            "created_at": "2022-09-04T14:36:17.401509Z",
            "updated_at": "2022-09-04T14:36:17.401534Z",
            "structure_string": "Sc4 U12 S24\n1.0\n3.768893 0.000000 0.000000\n0.000000 13.373972 0.000000\n0.000000 0.000000 16.437898\nSc U S\n4 12 24\ndirect\n0.500000 0.000000 0.500000 Sc\n0.000000 0.500000 0.000000 Sc\n0.500000 0.000000 0.000000 Sc\n0.000000 0.500000 0.500000 Sc\n0.000000 0.948764 0.784251 U\n0.500000 0.678733 0.849796 U\n0.000000 0.178733 0.650205 U\n0.500000 0.321267 0.150205 U\n0.500000 0.251124 0.900967 U\n0.500000 0.748876 0.099033 U\n0.000000 0.751124 0.599033 U\n0.000000 0.248876 0.400967 U\n0.500000 0.551236 0.284251 U\n0.500000 0.448764 0.715749 U\n0.000000 0.821267 0.349796 U\n0.000000 0.051236 0.215749 U\n0.000000 0.626596 0.392466 S\n0.500000 0.873404 0.892466 S\n0.500000 0.126596 0.107534 S\n0.000000 0.373404 0.607534 S\n0.500000 0.813813 0.712882 S\n0.000000 0.092469 0.921727 S\n0.500000 0.186187 0.287118 S\n0.000000 0.313813 0.787118 S\n0.000000 0.686187 0.212882 S\n0.500000 0.525200 0.106242 S\n0.500000 0.474800 0.893759 S\n0.000000 0.025200 0.393759 S\n0.000000 0.974800 0.606242 S\n0.500000 0.407531 0.421727 S\n0.500000 0.810877 0.476540 S\n0.000000 0.310877 0.023460 S\n0.000000 0.689123 0.976540 S\n0.500000 0.899910 0.245381 S\n0.500000 0.100090 0.754619 S\n0.000000 0.399910 0.254619 S\n0.000000 0.600090 0.745382 S\n0.000000 0.907530 0.078273 S\n0.500000 0.189123 0.523460 S\n0.500000 0.592469 0.578273 S\n",
            "nsites": 40,
            "nelements": 3,
            "elements": [
                "Sc",
                "U",
                "S"
            ],
            "chemical_system": "S-Sc-U",
            "density": 7.627226390852902,
            "density_atomic": 0.048276913070191003,
            "volume": 828.5533903512639,
            "volume_molar": 12.474162859676344,
            "formula_full": "Sc4 U12 S24",
            "formula_reduced": "Sc(US2)3",
            "formula_anonymous": "AB3C6",
            "energy_above_hull": 3.645356325,
            "spacegroup": 58
        },
        {
            "id": "jvasp-23445",
            "created_at": "2022-09-04T14:37:38.767663Z",
            "updated_at": "2022-09-04T14:37:38.767688Z",
            "structure_string": "Sc4 V2 B4 Ir10\n1.0\n9.296206 0.000000 0.000000\n0.000000 9.296206 -0.000000\n0.000000 0.000000 3.160453\nSc V B Ir\n4 2 4 10\ndirect\n0.176087 0.676088 0.000000 Sc\n0.823913 0.323913 0.000000 Sc\n0.323913 0.176087 0.000000 Sc\n0.676088 0.823913 0.000000 Sc\n0.000000 0.000000 0.000000 V\n0.500000 0.500000 0.000000 V\n0.122268 0.377732 0.000000 B\n0.622269 0.122268 0.000000 B\n0.377732 0.877732 0.000000 B\n0.877732 0.622269 0.000000 B\n0.215045 0.928611 0.500000 Ir\n0.500000 0.000000 0.500000 Ir\n0.715045 0.571389 0.500000 Ir\n0.571389 0.284955 0.500000 Ir\n0.428611 0.715045 0.500000 Ir\n0.284955 0.428611 0.500000 Ir\n0.000000 0.500000 0.500000 Ir\n0.928611 0.784955 0.500000 Ir\n0.784955 0.071389 0.500000 Ir\n0.071389 0.215045 0.500000 Ir\n",
            "nsites": 20,
            "nelements": 4,
            "elements": [
                "Sc",
                "V",
                "B",
                "Ir"
            ],
            "chemical_system": "B-Ir-Sc-V",
            "density": 13.662012354624908,
            "density_atomic": 0.07322665257521371,
            "volume": 273.1245973514532,
            "volume_molar": 8.223973851343871,
            "formula_full": "Sc4 V2 B4 Ir10",
            "formula_reduced": "Sc2VB2Ir5",
            "formula_anonymous": "AB2C2D5",
            "energy_above_hull": 4.912020536666667,
            "spacegroup": 127
        },
        {
            "id": "jvasp-46266",
            "created_at": "2022-09-04T14:38:04.508378Z",
            "updated_at": "2022-09-04T14:38:04.508388Z",
            "structure_string": "Sc4 V4 O12\n1.0\n5.048247 0.000000 0.000000\n0.000000 5.434162 0.000000\n0.000000 0.000000 7.506109\nSc V O\n4 4 12\ndirect\n0.975253 0.072393 0.250000 Sc\n0.475253 0.427607 0.750000 Sc\n0.524748 0.572393 0.250000 Sc\n0.024747 0.927606 0.750000 Sc\n0.500000 0.000000 0.000000 V\n0.500000 0.000000 0.500000 V\n0.000000 0.500000 0.000000 V\n0.000000 0.500000 0.500000 V\n0.817054 0.809758 0.070735 O\n0.317054 0.690242 0.929265 O\n0.317054 0.690242 0.570735 O\n0.857792 0.563516 0.750000 O\n0.142209 0.436483 0.250000 O\n0.182946 0.190242 0.570735 O\n0.682946 0.309758 0.070735 O\n0.182946 0.190242 0.929265 O\n0.817054 0.809758 0.429265 O\n0.642209 0.063517 0.750000 O\n0.682946 0.309758 0.429265 O\n0.357792 0.936483 0.250000 O\n",
            "nsites": 20,
            "nelements": 3,
            "elements": [
                "Sc",
                "V",
                "O"
            ],
            "chemical_system": "O-Sc-V",
            "density": 4.641609449590327,
            "density_atomic": 0.09712744217675949,
            "volume": 205.9150282533186,
            "volume_molar": 6.200246423704308,
            "formula_full": "Sc4 V4 O12",
            "formula_reduced": "ScVO3",
            "formula_anonymous": "ABC3",
            "energy_above_hull": 2.40285799,
            "spacegroup": 62
        },
        {
            "id": "jvasp-35946",
            "created_at": "2022-09-04T14:38:32.756920Z",
            "updated_at": "2022-09-04T14:38:32.756948Z",
            "structure_string": "Sc4 Zn2 S8\n1.0\n-5.255499 -5.255499 0.000000\n-5.255499 -0.000000 -5.255499\n0.000000 -5.255499 -5.255499\nSc Zn S\n4 2 8\ndirect\n0.000000 0.000000 0.500000 Sc\n0.000000 0.500000 -0.000000 Sc\n0.500000 0.000000 0.000000 Sc\n0.000000 0.000000 0.000000 Sc\n0.375000 0.375000 0.375000 Zn\n0.625000 0.625000 0.625000 Zn\n0.245022 0.245022 0.764934 S\n0.245022 0.764934 0.245022 S\n0.764934 0.245022 0.245022 S\n0.245022 0.245022 0.245022 S\n0.754978 0.754978 0.235066 S\n0.754978 0.235066 0.754978 S\n0.235066 0.754978 0.754978 S\n0.754978 0.754978 0.754978 S\n",
            "nsites": 14,
            "nelements": 3,
            "elements": [
                "Sc",
                "Zn",
                "S"
            ],
            "chemical_system": "S-Sc-Zn",
            "density": 3.2440241916112593,
            "density_atomic": 0.04822321562277286,
            "volume": 290.3165999861001,
            "volume_molar": 12.48805307200649,
            "formula_full": "Sc4 Zn2 S8",
            "formula_reduced": "Sc2ZnS4",
            "formula_anonymous": "AB2C4",
            "energy_above_hull": 1.5786401285714289,
            "spacegroup": 227
        },
        {
            "id": "jvasp-35948",
            "created_at": "2022-09-04T14:38:34.066712Z",
            "updated_at": "2022-09-04T14:38:34.066763Z",
            "structure_string": "Sc4 Zn2 Se8\n1.0\n-5.512592 -5.512592 -0.000000\n-5.512592 -0.000000 -5.512592\n0.000000 -5.512592 -5.512592\nSc Zn Se\n4 2 8\ndirect\n0.000000 0.000000 0.500000 Sc\n0.000000 0.500000 0.000000 Sc\n0.500000 0.000000 0.000000 Sc\n0.000000 0.000000 0.000000 Sc\n0.375000 0.375000 0.375000 Zn\n0.625000 0.625000 0.625000 Zn\n0.245044 0.245044 0.764869 Se\n0.245044 0.764869 0.245044 Se\n0.764869 0.245044 0.245044 Se\n0.245044 0.245044 0.245044 Se\n0.754956 0.754956 0.235131 Se\n0.754956 0.235131 0.754956 Se\n0.235131 0.754956 0.754956 Se\n0.754956 0.754956 0.754956 Se\n",
            "nsites": 14,
            "nelements": 3,
            "elements": [
                "Sc",
                "Zn",
                "Se"
            ],
            "chemical_system": "Sc-Se-Zn",
            "density": 4.670363876865492,
            "density_atomic": 0.041785970035649725,
            "volume": 335.0406844224483,
            "volume_molar": 14.411872585133736,
            "formula_full": "Sc4 Zn2 Se8",
            "formula_reduced": "Sc2ZnSe4",
            "formula_anonymous": "AB2C4",
            "energy_above_hull": 1.2885606238095235,
            "spacegroup": 227
        },
        {
            "id": "jvasp-21903",
            "created_at": "2022-09-04T14:37:42.759439Z",
            "updated_at": "2022-09-04T14:37:42.759463Z",
            "structure_string": "Sc4 Zn8\n1.0\n2.633971 -4.562171 -0.000000\n2.633971 4.562171 0.000000\n0.000000 -0.000000 8.430183\nSc Zn\n4 8\ndirect\n0.333333 0.666667 0.438000 Sc\n0.666667 0.333333 0.938000 Sc\n0.666667 0.333333 0.562000 Sc\n0.333333 0.666667 0.062000 Sc\n0.000000 0.000000 0.000000 Zn\n0.000000 0.000000 0.500000 Zn\n0.171422 0.828577 0.750000 Zn\n0.828577 0.657156 0.250000 Zn\n0.342844 0.171422 0.250000 Zn\n0.657156 0.828577 0.750000 Zn\n0.171422 0.342844 0.750000 Zn\n0.828577 0.171422 0.250000 Zn\n",
            "nsites": 12,
            "nelements": 2,
            "elements": [
                "Sc",
                "Zn"
            ],
            "chemical_system": "Sc-Zn",
            "density": 5.762540101766549,
            "density_atomic": 0.05922863167540262,
            "volume": 202.60471431730787,
            "volume_molar": 10.167617568820127,
            "formula_full": "Sc4 Zn8",
            "formula_reduced": "ScZn2",
            "formula_anonymous": "AB2",
            "energy_above_hull": 0.265956138888889,
            "spacegroup": 194
        },
        {
            "id": "jvasp-29267",
            "created_at": "2022-09-04T14:38:02.339312Z",
            "updated_at": "2022-09-04T14:38:02.339338Z",
            "structure_string": "Sc5 C1 Cl8\n1.0\n3.467314 0.000000 0.658189\n1.528008 8.811306 1.412445\n-0.004119 0.011528 9.483626\nSc C Cl\n5 1 8\ndirect\n0.837859 0.648347 0.675933 Sc\n0.162140 0.351653 0.324067 Sc\n0.486399 0.639596 0.387605 Sc\n0.513600 0.360404 0.612395 Sc\n0.000000 0.000000 0.000000 Sc\n0.000000 0.500000 0.500000 C\n0.033072 0.172980 0.760876 Cl\n0.966927 0.827020 0.239124 Cl\n0.329992 0.503823 0.836191 Cl\n0.670007 0.496177 0.163809 Cl\n0.702847 0.163098 0.431205 Cl\n0.297152 0.836903 0.568795 Cl\n0.367992 0.164718 0.099297 Cl\n0.632007 0.835282 0.900703 Cl\n",
            "nsites": 14,
            "nelements": 3,
            "elements": [
                "Sc",
                "C",
                "Cl"
            ],
            "chemical_system": "C-Cl-Sc",
            "density": 2.982784317906398,
            "density_atomic": 0.04832274549030353,
            "volume": 289.7186378371082,
            "volume_molar": 12.462331556075197,
            "formula_full": "Sc5 C1 Cl8",
            "formula_reduced": "Sc5CCl8",
            "formula_anonymous": "AB5C8",
            "energy_above_hull": 1.6125070564285715,
            "spacegroup": 12
        }
    ]
}