GET /third-parties/MatprojStructure/?format=api&ordering=-decomposes_to&page=12186
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=-decomposes_to&page=12187",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-decomposes_to&page=12185",
    "results": [
        {
            "id": "mp-1521735",
            "created_at": "2022-09-04T14:39:17.605881Z",
            "structure_string": "Na1 Sm1 Mn4 O12\n1.0\n5.327929 0.000000 0.000000\n0.000000 5.327929 0.000000\n0.000000 -0.000000 7.769804\nNa Sm Mn O\n1 1 4 12\ndirect\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 -0.000000 Sm\n0.000000 0.500000 0.739043 Mn\n0.000000 0.500000 0.260957 Mn\n0.500000 -0.000000 0.739043 Mn\n0.500000 0.000000 0.260957 Mn\n0.241026 0.241026 0.772467 O\n0.241026 0.241026 0.227533 O\n0.758974 0.758974 0.772467 O\n0.758974 0.758974 0.227533 O\n0.758974 0.241026 0.772467 O\n0.758974 0.241026 0.227533 O\n0.241026 0.758974 0.772467 O\n0.241026 0.758974 0.227533 O\n0.000000 0.500000 0.500000 O\n0.000000 0.500000 -0.000000 O\n0.500000 -0.000000 0.500000 O\n0.500000 0.000000 -0.000000 O\n",
            "nsites": 18,
            "nelements": 4,
            "elements": [
                "Na",
                "Sm",
                "Mn",
                "O"
            ],
            "chemical_system": "Mn-Na-O-Sm",
            "density": 4.405024995779986,
            "density_atomic": 0.08161041457283744,
            "volume": 220.56008530547248,
            "volume_molar": 7.379132665262016,
            "formula_full": "Na1 Sm1 Mn4 O12",
            "formula_reduced": "NaSmMn4O12",
            "formula_anonymous": "ABC4D12",
            "energy": -132.03573008,
            "energy_per_atom": -7.335318337777778,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -117.11973008,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 8.0000026,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:37.126000Z",
            "spacegroup": 123
        },
        {
            "id": "mp-1185285",
            "created_at": "2022-09-04T14:39:17.610656Z",
            "structure_string": "Li1 Ac1 Hg2\n1.0\n0.000000 3.805398 3.805398\n3.805398 0.000000 3.805398\n3.805398 3.805398 0.000000\nLi Ac Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Ac\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.750000 Hg\n",
            "nsites": 4,
            "nelements": 3,
            "elements": [
                "Li",
                "Ac",
                "Hg"
            ],
            "chemical_system": "Ac-Hg-Li",
            "density": 9.569193084911445,
            "density_atomic": 0.03629357412957218,
            "volume": 110.2123473901894,
            "volume_molar": 16.59285673684348,
            "formula_full": "Li1 Ac1 Hg2",
            "formula_reduced": "LiAcHg2",
            "formula_anonymous": "ABC2",
            "energy": -8.29800201,
            "energy_per_atom": -2.0745005025,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -8.29800201,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0009898,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:27.452000Z",
            "spacegroup": 225
        },
        {
            "id": "mp-1187947",
            "created_at": "2022-09-04T14:39:17.630634Z",
            "structure_string": "Yb3 Al1\n1.0\n0.000000 3.911690 3.911690\n3.911690 0.000000 3.911690\n3.911690 3.911690 0.000000\nYb Al\n3 1\ndirect\n0.750000 0.750000 0.750000 Yb\n0.250000 0.250000 0.250000 Yb\n0.500000 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 Al\n",
            "nsites": 4,
            "nelements": 2,
            "elements": [
                "Yb",
                "Al"
            ],
            "chemical_system": "Al-Yb",
            "density": 7.575289114199674,
            "density_atomic": 0.03341463382514723,
            "volume": 119.70803034775963,
            "volume_molar": 18.022465221414006,
            "formula_full": "Yb3 Al1",
            "formula_reduced": "Yb3Al",
            "formula_anonymous": "AB3",
            "energy": -8.51911548,
            "energy_per_atom": -2.12977887,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -8.51911548,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0165095,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:30.518000Z",
            "spacegroup": 225
        },
        {
            "id": "mp-975933",
            "created_at": "2022-09-04T14:39:24.938222Z",
            "structure_string": "Nd1 Ho1 In2\n1.0\n0.000000 3.816183 3.816183\n3.816183 0.000000 3.816183\n3.816183 3.816183 0.000000\nNd Ho In\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.500000 Ho\n0.250000 0.250000 0.250000 In\n0.750000 0.750000 0.750000 In\n",
            "nsites": 4,
            "nelements": 3,
            "elements": [
                "Nd",
                "Ho",
                "In"
            ],
            "chemical_system": "Ho-In-Nd",
            "density": 8.049442778029876,
            "density_atomic": 0.03598673269604541,
            "volume": 111.15207467666441,
            "volume_molar": 16.734335986722616,
            "formula_full": "Nd1 Ho1 In2",
            "formula_reduced": "NdHoIn2",
            "formula_anonymous": "ABC2",
            "energy": -16.71242412,
            "energy_per_atom": -4.17810603,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -16.71242412,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0006359,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:41.511000Z",
            "spacegroup": 225
        },
        {
            "id": "mp-17495",
            "created_at": "2022-09-04T14:39:17.445014Z",
            "structure_string": "Rb4 Ti4 P8 O28\n1.0\n10.432680 0.000000 0.000000\n0.000000 7.670572 0.000000\n0.000000 2.277524 8.043821\nRb Ti P O\n4 4 8 28\ndirect\n0.182824 0.189298 0.944580 Rb\n0.682824 0.810702 0.555420 Rb\n0.817176 0.810702 0.055420 Rb\n0.317176 0.189298 0.444580 Rb\n0.898355 0.237699 0.241215 Ti\n0.398355 0.762301 0.258785 Ti\n0.101645 0.762301 0.758785 Ti\n0.601645 0.237699 0.741215 Ti\n0.597472 0.131662 0.171653 P\n0.097472 0.868338 0.328347 P\n0.402528 0.868338 0.828347 P\n0.902528 0.131662 0.671653 P\n0.634368 0.435619 0.313781 P\n0.134368 0.564381 0.186219 P\n0.365632 0.564381 0.686219 P\n0.865632 0.435619 0.813781 P\n0.589313 0.154115 0.985152 O\n0.089313 0.845885 0.514848 O\n0.410687 0.845885 0.014848 O\n0.910687 0.154115 0.485152 O\n0.499446 0.997567 0.270969 O\n0.999446 0.002433 0.229031 O\n0.500554 0.002433 0.729031 O\n0.000554 0.997567 0.770969 O\n0.733618 0.083754 0.239111 O\n0.233618 0.916246 0.260889 O\n0.266382 0.916246 0.760889 O\n0.766382 0.083754 0.739111 O\n0.559065 0.328014 0.197611 O\n0.059065 0.671986 0.302389 O\n0.440935 0.671986 0.802389 O\n0.940935 0.328014 0.697611 O\n0.723312 0.445331 0.766810 O\n0.223312 0.554669 0.733190 O\n0.276688 0.554669 0.233190 O\n0.776688 0.445331 0.266810 O\n0.892318 0.324109 0.993291 O\n0.392318 0.675891 0.506709 O\n0.107682 0.675891 0.006709 O\n0.607682 0.324109 0.493291 O\n0.924283 0.624561 0.771476 O\n0.424283 0.375439 0.728524 O\n0.075717 0.375439 0.228524 O\n0.575717 0.624561 0.271476 O\n",
            "nsites": 44,
            "nelements": 4,
            "elements": [
                "Rb",
                "Ti",
                "P",
                "O"
            ],
            "chemical_system": "O-P-Rb-Ti",
            "density": 3.170696670112609,
            "density_atomic": 0.06835442612702239,
            "volume": 643.7037437522365,
            "volume_molar": 8.810169437761225,
            "formula_full": "Rb4 Ti4 P8 O28",
            "formula_reduced": "RbTiP2O7",
            "formula_anonymous": "ABC2D7",
            "energy": -344.00680001,
            "energy_per_atom": -7.8183363638636365,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -324.77080001,
            "band_gap": 0.0,
            "is_gap_direct": true,
            "is_magnetic": true,
            "total_magnetization": 4.0011163,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:43.530000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-1201938",
            "created_at": "2022-09-04T14:39:17.453033Z",
            "structure_string": "Al4 H84 C12 S12 O60\n1.0\n6.542184 0.000000 0.000000\n0.000000 16.928472 0.000000\n0.000000 8.786250 15.764659\nAl H C S O\n4 84 12 12 60\ndirect\n0.009145 0.783025 0.123948 Al\n0.490855 0.783025 0.623948 Al\n0.990855 0.216975 0.876052 Al\n0.509145 0.216975 0.376052 Al\n0.961116 0.616097 0.240134 H\n0.538884 0.616097 0.740134 H\n0.038884 0.383903 0.759866 H\n0.461116 0.383903 0.259866 H\n0.854098 0.630934 0.151816 H\n0.645902 0.630934 0.651816 H\n0.145902 0.369066 0.848184 H\n0.354098 0.369066 0.348184 H\n0.655224 0.794228 0.186583 H\n0.844776 0.794228 0.686583 H\n0.344776 0.205772 0.813417 H\n0.155224 0.205772 0.313417 H\n0.736295 0.893284 0.118298 H\n0.763705 0.893284 0.618298 H\n0.263705 0.106716 0.881702 H\n0.236295 0.106716 0.381702 H\n0.236820 0.763009 0.249446 H\n0.263180 0.763009 0.749446 H\n0.763180 0.236991 0.750554 H\n0.736820 0.236991 0.250554 H\n0.989386 0.760756 0.274159 H\n0.510614 0.760756 0.774159 H\n0.010614 0.239244 0.725841 H\n0.489386 0.239244 0.225841 H\n0.960755 0.775450 0.980864 H\n0.539245 0.775450 0.480864 H\n0.039245 0.224550 0.019136 H\n0.460755 0.224550 0.519136 H\n0.766255 0.821941 0.000156 H\n0.733745 0.821941 0.500156 H\n0.233745 0.178059 0.999844 H\n0.266255 0.178059 0.499844 H\n0.328270 0.684920 0.131138 H\n0.171730 0.684920 0.631138 H\n0.671730 0.315080 0.868862 H\n0.828270 0.315080 0.368862 H\n0.358225 0.791021 0.057245 H\n0.141775 0.791021 0.557245 H\n0.641775 0.208979 0.942755 H\n0.858225 0.208979 0.442755 H\n0.185418 0.932263 0.094591 H\n0.314582 0.932263 0.594591 H\n0.814582 0.067737 0.905409 H\n0.685418 0.067737 0.405409 H\n0.161163 0.933817 0.006595 H\n0.338837 0.933817 0.506595 H\n0.838837 0.066183 0.993405 H\n0.661163 0.066183 0.493405 H\n0.618031 0.578365 0.463687 H\n0.881969 0.578365 0.963687 H\n0.381969 0.421635 0.536313 H\n0.118031 0.421635 0.036313 H\n0.400974 0.587462 0.397715 H\n0.099026 0.587462 0.897715 H\n0.599026 0.412538 0.602285 H\n0.900974 0.412538 0.102285 H\n0.655082 0.582712 0.362210 H\n0.844918 0.582712 0.862210 H\n0.344918 0.417288 0.637790 H\n0.155082 0.417288 0.137790 H\n0.542027 0.898142 0.801969 H\n0.957973 0.898142 0.301969 H\n0.457973 0.101858 0.198031 H\n0.042027 0.101858 0.698031 H\n0.275644 0.889701 0.828935 H\n0.224356 0.889701 0.328935 H\n0.724356 0.110299 0.171065 H\n0.775644 0.110299 0.671065 H\n0.385634 0.998481 0.757367 H\n0.114366 0.998481 0.257367 H\n0.614366 0.001519 0.242633 H\n0.885634 0.001519 0.742633 H\n0.478314 0.576465 0.983132 H\n0.021686 0.576465 0.483132 H\n0.521686 0.423535 0.016868 H\n0.978314 0.423535 0.516868 H\n0.254176 0.588696 0.034995 H\n0.245824 0.588696 0.534995 H\n0.745824 0.411304 0.965005 H\n0.754176 0.411304 0.465005 H\n0.442790 0.677154 0.990367 H\n0.057210 0.677154 0.490367 H\n0.557210 0.322846 0.009633 H\n0.942790 0.322846 0.509633 H\n0.561583 0.605504 0.398593 C\n0.938417 0.605504 0.898593 C\n0.438417 0.394496 0.601407 C\n0.061583 0.394496 0.101407 C\n0.412594 0.932228 0.812969 C\n0.087406 0.932228 0.312969 C\n0.587406 0.067772 0.187031 C\n0.912594 0.067772 0.687031 C\n0.417171 0.603959 0.022437 C\n0.082829 0.603959 0.522437 C\n0.582829 0.396041 0.977563 C\n0.917171 0.396041 0.477563 C\n0.580782 0.724943 0.349124 S\n0.919218 0.724943 0.849124 S\n0.419218 0.275057 0.650876 S\n0.080782 0.275057 0.150876 S\n0.475760 0.948816 0.899948 S\n0.024240 0.948816 0.399948 S\n0.524240 0.051184 0.100052 S\n0.975760 0.051184 0.600052 S\n0.542013 0.555386 0.122646 S\n0.957987 0.555386 0.622646 S\n0.457987 0.444614 0.877354 S\n0.042013 0.444614 0.377354 S\n0.483248 0.759234 0.263967 O\n0.016752 0.759234 0.763967 O\n0.516752 0.240766 0.736033 O\n0.983248 0.240766 0.236033 O\n0.799309 0.748408 0.340355 O\n0.700691 0.748408 0.840355 O\n0.200691 0.251592 0.659645 O\n0.299309 0.251592 0.159645 O\n0.467445 0.754235 0.401771 O\n0.032555 0.754235 0.901771 O\n0.532555 0.245765 0.598229 O\n0.967445 0.245765 0.098229 O\n0.516665 0.857404 0.973416 O\n0.983335 0.857404 0.473416 O\n0.483335 0.142596 0.026584 O\n0.016665 0.142596 0.526584 O\n0.292038 0.989755 0.916861 O\n0.207962 0.989755 0.416861 O\n0.707962 0.010245 0.083139 O\n0.792038 0.010245 0.583139 O\n0.654648 0.007840 0.874650 O\n0.845352 0.007840 0.374650 O\n0.345352 0.992160 0.125350 O\n0.154648 0.992160 0.625350 O\n0.758814 0.583111 0.104599 O\n0.741186 0.583111 0.604599 O\n0.241186 0.416889 0.895401 O\n0.258814 0.416889 0.395401 O\n0.516244 0.456519 0.161554 O\n0.983756 0.456519 0.661554 O\n0.483756 0.543481 0.838446 O\n0.016244 0.543481 0.338446 O\n0.437960 0.592708 0.171449 O\n0.062040 0.592708 0.671449 O\n0.562040 0.407292 0.828551 O\n0.937960 0.407292 0.328551 O\n0.918506 0.662724 0.181386 O\n0.581494 0.662724 0.681386 O\n0.081494 0.337276 0.818614 O\n0.418506 0.337276 0.318614 O\n0.750603 0.827624 0.137407 O\n0.749397 0.827624 0.637407 O\n0.249397 0.172376 0.862593 O\n0.250603 0.172376 0.362593 O\n0.091938 0.774220 0.228501 O\n0.408062 0.774220 0.728501 O\n0.908062 0.225780 0.771499 O\n0.591938 0.225780 0.271499 O\n0.908675 0.799763 0.017809 O\n0.591325 0.799763 0.517809 O\n0.091325 0.200237 0.982191 O\n0.408675 0.200237 0.482191 O\n0.267467 0.748384 0.103744 O\n0.232533 0.748384 0.603744 O\n0.732533 0.251616 0.896256 O\n0.767467 0.251616 0.396256 O\n0.102532 0.906422 0.065300 O\n0.397468 0.906422 0.565300 O\n0.897468 0.093578 0.934700 O\n0.602532 0.093578 0.434700 O\n",
            "nsites": 172,
            "nelements": 5,
            "elements": [
                "Al",
                "H",
                "C",
                "S",
                "O"
            ],
            "chemical_system": "Al-C-H-O-S",
            "density": 1.5992338253117473,
            "density_atomic": 0.09851522457673505,
            "volume": 1745.9230361498746,
            "volume_molar": 6.112903651058787,
            "formula_full": "Al4 H84 C12 S12 O60",
            "formula_reduced": "AlH21C3(SO5)3",
            "formula_anonymous": "AB3C3D15E21",
            "energy": -969.87042112,
            "energy_per_atom": -5.638781518139535,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -928.65042112,
            "band_gap": 5.3382,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.4180809,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:40.963000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-22575",
            "created_at": "2022-09-04T14:39:17.453984Z",
            "structure_string": "Sc12 As8\n1.0\n3.844194 0.000000 0.000000\n0.000000 10.332235 0.000000\n0.000000 0.000000 10.455265\nSc As\n12 8\ndirect\n0.250000 0.132397 0.048646 Sc\n0.750000 0.867603 0.951354 Sc\n0.250000 0.367603 0.548646 Sc\n0.750000 0.632397 0.451354 Sc\n0.250000 0.063644 0.372140 Sc\n0.750000 0.936356 0.627860 Sc\n0.250000 0.436356 0.872140 Sc\n0.750000 0.563644 0.127860 Sc\n0.250000 0.796464 0.223119 Sc\n0.750000 0.203536 0.776881 Sc\n0.250000 0.703536 0.723119 Sc\n0.750000 0.296464 0.276881 Sc\n0.250000 0.494646 0.313097 As\n0.750000 0.505354 0.686903 As\n0.250000 0.005354 0.813097 As\n0.750000 0.994646 0.186903 As\n0.250000 0.820942 0.486505 As\n0.750000 0.179058 0.513495 As\n0.250000 0.679058 0.986505 As\n0.750000 0.320942 0.013495 As\n",
            "nsites": 20,
            "nelements": 2,
            "elements": [
                "Sc",
                "As"
            ],
            "chemical_system": "As-Sc",
            "density": 4.553848949653526,
            "density_atomic": 0.048160987016088515,
            "volume": 415.2738811876688,
            "volume_molar": 12.504188832318286,
            "formula_full": "Sc12 As8",
            "formula_reduced": "Sc3As2",
            "formula_anonymous": "A2B3",
            "energy": -136.34364098,
            "energy_per_atom": -6.817182049,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -136.34364098,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 1.4337898,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:25.779000Z",
            "spacegroup": 62
        },
        {
            "id": "mp-27254",
            "created_at": "2022-09-04T14:39:17.454798Z",
            "structure_string": "Ba2 Te4 O12\n1.0\n2.831459 -6.566149 0.000000\n2.831459 6.566149 0.000000\n0.000000 0.000000 7.461716\nBa Te O\n2 4 12\ndirect\n0.722077 0.277923 0.750000 Ba\n0.277923 0.722077 0.250000 Ba\n0.000000 0.000000 0.000000 Te\n0.000000 0.000000 0.500000 Te\n0.584791 0.415209 0.250000 Te\n0.415209 0.584791 0.750000 Te\n0.868423 0.658315 0.044754 O\n0.658315 0.868423 0.955246 O\n0.131577 0.341685 0.544754 O\n0.341685 0.131577 0.455246 O\n0.131577 0.341685 0.955246 O\n0.341685 0.131577 0.044754 O\n0.048416 0.951584 0.750000 O\n0.951584 0.048416 0.250000 O\n0.274089 0.725911 0.750000 O\n0.725911 0.274089 0.250000 O\n0.658315 0.868423 0.544754 O\n0.868423 0.658315 0.455246 O\n",
            "nsites": 18,
            "nelements": 3,
            "elements": [
                "Ba",
                "Te",
                "O"
            ],
            "chemical_system": "Ba-O-Te",
            "density": 5.847560747675655,
            "density_atomic": 0.06487580849472271,
            "volume": 277.45318968108427,
            "volume_molar": 9.282567569835939,
            "formula_full": "Ba2 Te4 O12",
            "formula_reduced": "Ba(TeO3)2",
            "formula_anonymous": "AB2C6",
            "energy": -111.74894337,
            "energy_per_atom": -6.208274631666667,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -103.50494337,
            "band_gap": 1.7620000000000005,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0008128,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:30.140000Z",
            "spacegroup": 63
        },
        {
            "id": "mp-760140",
            "created_at": "2022-09-04T14:39:17.457110Z",
            "structure_string": "Li12 V6 F36\n1.0\n8.580343 0.000000 0.000000\n4.123567 7.651562 0.000000\n0.927221 0.342523 10.210143\nLi V F\n12 6 36\ndirect\n0.304806 0.984927 0.725303 Li\n0.945411 0.654915 0.434018 Li\n0.874123 0.457260 0.958195 Li\n0.201882 0.803093 0.247389 Li\n0.997756 0.727995 0.773428 Li\n0.668268 0.379822 0.469142 Li\n0.623606 0.336891 0.024984 Li\n0.122422 0.562638 0.045410 Li\n0.550977 0.098230 0.548678 Li\n0.053295 0.343185 0.569886 Li\n0.707167 0.003808 0.269659 Li\n0.356519 0.045326 0.061355 Li\n0.002314 0.002055 0.498949 V\n0.662250 0.661417 0.711539 V\n0.989292 0.007302 0.995516 V\n0.665349 0.664827 0.206716 V\n0.336478 0.333023 0.793853 V\n0.338421 0.335518 0.294014 V\n0.925075 0.921771 0.649705 F\n0.927856 0.932482 0.161871 F\n0.572635 0.889270 0.628246 F\n0.582238 0.884816 0.119718 F\n0.774259 0.726922 0.827458 F\n0.751003 0.764507 0.329465 F\n0.212480 0.940338 0.575102 F\n0.892602 0.582084 0.605504 F\n0.446312 0.753266 0.806764 F\n0.213867 0.929672 0.072333 F\n0.889642 0.583911 0.109486 F\n0.441893 0.746221 0.289262 F\n0.594990 0.574899 0.583883 F\n0.060139 0.775235 0.937296 F\n0.753644 0.447599 0.810081 F\n0.610250 0.559790 0.075444 F\n0.078728 0.777572 0.424041 F\n0.749923 0.462203 0.310743 F\n0.234582 0.542321 0.703723 F\n0.908218 0.238595 0.549407 F\n0.414174 0.411740 0.926736 F\n0.242018 0.559554 0.200219 F\n0.908155 0.238813 0.049529 F\n0.434398 0.408850 0.412607 F\n0.546891 0.248430 0.688325 F\n0.108705 0.429069 0.897448 F\n0.761665 0.086546 0.949560 F\n0.560256 0.245230 0.192081 F\n0.120347 0.415651 0.398988 F\n0.761786 0.082356 0.437829 F\n0.258345 0.230824 0.664902 F\n0.254717 0.259133 0.167206 F\n0.392516 0.123286 0.885262 F\n0.434520 0.116595 0.384434 F\n0.088765 0.054665 0.843367 F\n0.076170 0.056515 0.340538 F\n",
            "nsites": 54,
            "nelements": 3,
            "elements": [
                "Li",
                "V",
                "F"
            ],
            "chemical_system": "F-Li-V",
            "density": 2.6577559210619506,
            "density_atomic": 0.08055772338947019,
            "volume": 670.3267883940525,
            "volume_molar": 7.475559768347628,
            "formula_full": "Li12 V6 F36",
            "formula_reduced": "Li2VF6",
            "formula_anonymous": "AB2C6",
            "energy": -315.23440398,
            "energy_per_atom": -5.837674147777778,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -288.40240398,
            "band_gap": 1.3538,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 3.9999859,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:30.182000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-560818",
            "created_at": "2022-09-04T14:39:17.460171Z",
            "structure_string": "Sr20 B12 O36 F4\n1.0\n7.308094 0.000000 0.000000\n0.000000 9.893289 0.000000\n0.000000 0.000000 14.297707\nSr B O F\n20 12 36 4\ndirect\n0.288942 0.481471 0.750000 Sr\n0.254937 0.625774 0.119764 Sr\n0.471852 0.245878 0.387773 Sr\n0.245063 0.125774 0.619764 Sr\n0.971852 0.254122 0.387773 Sr\n0.028148 0.745878 0.887773 Sr\n0.745063 0.374226 0.880236 Sr\n0.528148 0.754122 0.612227 Sr\n0.754937 0.874226 0.380236 Sr\n0.245063 0.125774 0.880236 Sr\n0.754937 0.874226 0.119764 Sr\n0.788942 0.018529 0.750000 Sr\n0.028148 0.745878 0.612227 Sr\n0.211058 0.981471 0.250000 Sr\n0.745063 0.374226 0.619764 Sr\n0.528148 0.754122 0.887773 Sr\n0.971852 0.254122 0.112227 Sr\n0.471852 0.245878 0.112227 Sr\n0.254937 0.625774 0.380236 Sr\n0.711058 0.518529 0.250000 Sr\n0.199626 0.938183 0.461279 B\n0.217727 0.389860 0.250000 B\n0.717727 0.110140 0.250000 B\n0.300374 0.438183 0.961279 B\n0.800374 0.061817 0.538721 B\n0.199626 0.938183 0.038721 B\n0.699626 0.561817 0.038721 B\n0.699626 0.561817 0.461279 B\n0.300374 0.438183 0.538721 B\n0.782273 0.610140 0.750000 B\n0.800374 0.061817 0.961279 B\n0.282273 0.889860 0.750000 B\n0.215004 0.248560 0.250000 O\n0.223953 0.070906 0.069833 O\n0.776047 0.929094 0.930167 O\n0.723953 0.429094 0.430167 O\n0.593102 0.652622 0.410485 O\n0.906898 0.152622 0.910485 O\n0.556486 0.036740 0.250000 O\n0.779364 0.603641 0.955134 O\n0.276047 0.570906 0.569833 O\n0.220636 0.396359 0.455134 O\n0.884855 0.044047 0.250000 O\n0.715004 0.251440 0.250000 O\n0.279364 0.896359 0.544866 O\n0.406898 0.347378 0.589515 O\n0.779364 0.603641 0.544866 O\n0.443514 0.963260 0.750000 O\n0.279364 0.896359 0.955134 O\n0.784996 0.751440 0.750000 O\n0.056486 0.463260 0.250000 O\n0.093102 0.847378 0.089515 O\n0.406898 0.347378 0.910485 O\n0.384855 0.455953 0.250000 O\n0.720636 0.103641 0.455134 O\n0.615145 0.544047 0.750000 O\n0.276047 0.570906 0.930167 O\n0.115145 0.955953 0.750000 O\n0.593102 0.652622 0.089515 O\n0.220636 0.396359 0.044866 O\n0.284996 0.748560 0.750000 O\n0.720636 0.103641 0.044866 O\n0.776047 0.929094 0.569833 O\n0.723953 0.429094 0.069833 O\n0.223953 0.070906 0.430167 O\n0.906898 0.152622 0.589515 O\n0.943514 0.536740 0.750000 O\n0.093102 0.847378 0.410485 O\n0.360035 0.763869 0.250000 F\n0.860035 0.736131 0.250000 F\n0.639965 0.236131 0.750000 F\n0.139965 0.263869 0.750000 F\n",
            "nsites": 72,
            "nelements": 4,
            "elements": [
                "Sr",
                "B",
                "O",
                "F"
            ],
            "chemical_system": "B-F-O-Sr",
            "density": 4.070636482736278,
            "density_atomic": 0.06965002601260425,
            "volume": 1033.739743140519,
            "volume_molar": 8.646286447775626,
            "formula_full": "Sr20 B12 O36 F4",
            "formula_reduced": "Sr5B3O9F",
            "formula_anonymous": "AB3C5D9",
            "energy": -539.13409057,
            "energy_per_atom": -7.487973480138889,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -512.55409057,
            "band_gap": 4.402200000000001,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0007744,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:36.169000Z",
            "spacegroup": 62
        },
        {
            "id": "mp-1224537",
            "created_at": "2022-09-04T14:39:17.502665Z",
            "structure_string": "Gd2 Ti2 Cd2 Sb2 O14\n1.0\n-3.609979 3.739043 5.150503\n3.609979 -3.739043 5.150503\n3.609979 3.739043 -5.150503\nGd Ti Cd Sb O\n2 2 2 2 14\ndirect\n0.500000 0.000000 0.500000 Gd\n0.000000 0.000000 0.000000 Gd\n0.000000 0.500000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.500000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Cd\n0.000000 0.500000 0.500000 Sb\n0.500000 0.500000 0.000000 Sb\n0.926852 0.176852 0.750000 O\n0.328395 0.578395 0.750000 O\n0.934775 0.581705 0.760937 O\n0.320768 0.173838 0.739063 O\n0.934775 0.173838 0.353070 O\n0.320768 0.581705 0.146930 O\n0.073148 0.823148 0.250000 O\n0.671605 0.421605 0.250000 O\n0.065225 0.418295 0.239063 O\n0.679232 0.826162 0.260937 O\n0.065225 0.826162 0.646930 O\n0.679232 0.418295 0.853070 O\n0.625545 0.875545 0.750000 O\n0.374455 0.124455 0.250000 O\n",
            "nsites": 22,
            "nelements": 5,
            "elements": [
                "Gd",
                "Ti",
                "Cd",
                "Sb",
                "O"
            ],
            "chemical_system": "Cd-Gd-O-Sb-Ti",
            "density": 6.583844312723059,
            "density_atomic": 0.07911301026355219,
            "volume": 278.0832119358189,
            "volume_molar": 7.612073842138243,
            "formula_full": "Gd2 Ti2 Cd2 Sb2 O14",
            "formula_reduced": "GdTiCdSbO7",
            "formula_anonymous": "ABCDE7",
            "energy": -184.6078163,
            "energy_per_atom": -8.391264377272726,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -174.9898163,
            "band_gap": 2.5972,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 14.0000094,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:28.789000Z",
            "spacegroup": 74
        },
        {
            "id": "mp-1200692",
            "created_at": "2022-09-04T14:39:17.461514Z",
            "structure_string": "Si17 C17\n1.0\n-1.547270 -2.679950 0.000000\n1.547270 -2.679950 0.000000\n0.000000 -1.786634 43.017268\nSi C\n17 17\ndirect\n0.000009 0.000009 0.999972 Si\n0.960798 0.960798 0.117607 Si\n0.882387 0.882387 0.352838 Si\n0.843130 0.843130 0.470609 Si\n0.764719 0.764719 0.705843 Si\n0.725499 0.725499 0.823503 Si\n0.647085 0.647085 0.058744 Si\n0.588228 0.588228 0.235316 Si\n0.529420 0.529420 0.411740 Si\n0.470598 0.470598 0.588206 Si\n0.411786 0.411786 0.764643 Si\n0.352928 0.352928 0.941216 Si\n0.274523 0.274523 0.176432 Si\n0.235298 0.235298 0.294107 Si\n0.156891 0.156891 0.529328 Si\n0.117631 0.117631 0.647107 Si\n0.039224 0.039224 0.882329 Si\n0.985319 0.985319 0.044044 C\n0.946092 0.946092 0.161724 C\n0.867685 0.867685 0.396944 C\n0.828424 0.828424 0.514727 C\n0.750014 0.750014 0.749957 C\n0.710792 0.710792 0.867623 C\n0.632340 0.632340 0.102979 C\n0.573486 0.573486 0.279541 C\n0.514676 0.514676 0.455971 C\n0.455850 0.455850 0.632449 C\n0.397043 0.397043 0.808871 C\n0.338188 0.338188 0.985435 C\n0.259818 0.259818 0.220547 C\n0.220594 0.220594 0.338219 C\n0.142183 0.142183 0.573450 C\n0.102926 0.102926 0.691222 C\n0.024514 0.024514 0.926458 C\n",
            "nsites": 34,
            "nelements": 2,
            "elements": [
                "Si",
                "C"
            ],
            "chemical_system": "C-Si",
            "density": 3.172748278034281,
            "density_atomic": 0.09530447639912479,
            "volume": 356.7513435319837,
            "volume_molar": 6.318843550202122,
            "formula_full": "Si17 C17",
            "formula_reduced": "SiC",
            "formula_anonymous": "AB",
            "energy": -254.9628363,
            "energy_per_atom": -7.498906949999999,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -254.9628363,
            "band_gap": 1.9692999999999987,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 1.08e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:28.442000Z",
            "spacegroup": 160
        }
    ]
}