GET /third-parties/MatprojStructure/?format=api&ordering=formula_full&page=11477
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=formula_full&page=11478",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=formula_full&page=11476",
    "results": [
        {
            "id": "mp-17751",
            "created_at": "2022-09-04T14:45:57.321475Z",
            "structure_string": "Y10 Ge6\n1.0\n4.265039 -7.387264 0.000000\n4.265039 7.387264 0.000000\n0.000000 0.000000 6.440943\nY Ge\n10 6\ndirect\n0.000000 0.757694 0.750000 Y\n0.000000 0.242306 0.250000 Y\n0.757694 0.757694 0.250000 Y\n0.757694 0.000000 0.750000 Y\n0.242306 0.242306 0.750000 Y\n0.242306 0.000000 0.250000 Y\n0.333333 0.666667 0.500000 Y\n0.666667 0.333333 0.000000 Y\n0.666667 0.333333 0.500000 Y\n0.333333 0.666667 0.000000 Y\n0.393765 0.000000 0.750000 Ge\n0.393765 0.393765 0.250000 Ge\n0.000000 0.606235 0.250000 Ge\n0.000000 0.393765 0.750000 Ge\n0.606235 0.606235 0.750000 Ge\n0.606235 0.000000 0.250000 Ge\n",
            "nsites": 16,
            "nelements": 2,
            "elements": [
                "Y",
                "Ge"
            ],
            "chemical_system": "Ge-Y",
            "density": 5.420578371060208,
            "density_atomic": 0.0394215689276327,
            "volume": 405.8691836789058,
            "volume_molar": 15.27625846412916,
            "formula_full": "Y10 Ge6",
            "formula_reduced": "Y5Ge3",
            "formula_anonymous": "A3B5",
            "energy": -105.73403309,
            "energy_per_atom": -6.608377068125,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -105.73403309,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0449933,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:09.540000Z",
            "spacegroup": 193
        },
        {
            "id": "mp-1178768",
            "created_at": "2022-09-04T14:39:17.296114Z",
            "structure_string": "Y10 Ge6 C2\n1.0\n8.528724 0.009554 0.000000\n-4.256088 7.390869 0.000000\n0.000000 0.000000 6.462133\nY Ge C\n10 6 2\ndirect\n0.666169 0.333840 0.500000 Y\n0.333840 0.666169 0.500000 Y\n0.333831 0.666160 0.000000 Y\n0.666160 0.333831 0.000000 Y\n0.777325 0.777325 0.250000 Y\n0.221322 0.000328 0.249999 Y\n0.000328 0.221322 0.249999 Y\n0.222675 0.222675 0.750000 Y\n0.778678 0.999672 0.749999 Y\n0.999672 0.778678 0.749999 Y\n0.406671 0.406671 0.249992 Ge\n0.592786 0.999990 0.250010 Ge\n0.999990 0.592786 0.250010 Ge\n0.593329 0.593329 0.749992 Ge\n0.407214 0.000010 0.750010 Ge\n0.000010 0.407214 0.750010 Ge\n0.000006 0.000006 0.499989 C\n0.999994 0.999994 0.999989 C\n",
            "nsites": 18,
            "nelements": 3,
            "elements": [
                "Y",
                "Ge",
                "C"
            ],
            "chemical_system": "C-Ge-Y",
            "density": 5.495405396193815,
            "density_atomic": 0.04416080503597197,
            "volume": 407.60126508875413,
            "volume_molar": 13.636845512880841,
            "formula_full": "Y10 Ge6 C2",
            "formula_reduced": "Y5Ge3C",
            "formula_anonymous": "AB3C5",
            "energy": -124.21853527,
            "energy_per_atom": -6.901029737222222,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -124.21853527,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.004093,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:45.169000Z",
            "spacegroup": 193
        },
        {
            "id": "mp-32697",
            "created_at": "2022-09-04T14:42:47.837564Z",
            "structure_string": "Y10 H21\n1.0\n6.378616 0.000000 0.000000\n-2.110565 7.054973 0.000000\n-1.073817 -2.232061 7.849895\nY H\n10 21\ndirect\n0.701251 0.653069 0.900191 Y\n0.500466 0.250001 0.500079 Y\n0.297351 0.851602 0.099324 Y\n0.702649 0.148398 0.900676 Y\n0.100477 0.449280 0.699778 Y\n0.499534 0.749999 0.499921 Y\n0.900019 0.049590 0.297334 Y\n0.298749 0.346931 0.099809 Y\n0.099981 0.950410 0.702666 Y\n0.899523 0.550720 0.300222 Y\n0.550717 0.975058 0.349562 H\n0.350868 0.575289 0.950819 H\n0.149147 0.173849 0.549469 H\n0.649132 0.424711 0.049181 H\n0.549072 0.475060 0.348663 H\n0.449283 0.024942 0.650438 H\n0.949486 0.769477 0.153128 H\n0.359449 0.077148 0.948676 H\n0.640551 0.922852 0.051324 H\n0.149690 0.676568 0.550117 H\n0.250009 0.624348 0.249098 H\n0.749991 0.375652 0.750902 H\n0.948826 0.282027 0.153039 H\n0.050514 0.230523 0.846872 H\n0.450928 0.524940 0.651337 H\n0.850853 0.826151 0.450531 H\n0.255668 0.127619 0.255962 H\n0.744332 0.872381 0.744038 H\n0.000000 0.000000 0.000000 H\n0.051174 0.717973 0.846961 H\n0.850310 0.323432 0.449883 H\n",
            "nsites": 31,
            "nelements": 2,
            "elements": [
                "Y",
                "H"
            ],
            "chemical_system": "H-Y",
            "density": 4.278704658390494,
            "density_atomic": 0.08775584092770194,
            "volume": 353.2528396091548,
            "volume_molar": 6.862381690309785,
            "formula_full": "Y10 H21",
            "formula_reduced": "Y10H21",
            "formula_anonymous": "A10B21",
            "energy": -160.76805446999998,
            "energy_per_atom": -5.186066273225806,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -157.00905447,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0031112,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:59.183000Z",
            "spacegroup": 2
        },
        {
            "id": "mp-980936",
            "created_at": "2022-09-04T14:47:28.677013Z",
            "structure_string": "Y10 In8 Pd4\n1.0\n3.662293 0.000000 0.000000\n0.000000 8.122049 0.000000\n0.000000 0.000000 18.369847\nY In Pd\n10 8 4\ndirect\n0.500000 0.240350 0.781647 Y\n0.500000 0.759650 0.218353 Y\n0.500000 0.259650 0.281647 Y\n0.500000 0.740350 0.718353 Y\n0.500000 0.119460 0.581385 Y\n0.500000 0.880540 0.418615 Y\n0.500000 0.380540 0.081385 Y\n0.500000 0.619460 0.918615 Y\n0.500000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Y\n0.000000 0.078929 0.150309 In\n0.000000 0.921071 0.849691 In\n0.000000 0.421071 0.650309 In\n0.000000 0.578929 0.349691 In\n0.000000 0.209624 0.431766 In\n0.000000 0.790376 0.568234 In\n0.000000 0.290376 0.931766 In\n0.000000 0.709624 0.068234 In\n0.000000 0.026220 0.695014 Pd\n0.000000 0.973780 0.304986 Pd\n0.000000 0.473780 0.195014 Pd\n0.000000 0.526220 0.804986 Pd\n",
            "nsites": 22,
            "nelements": 3,
            "elements": [
                "Y",
                "In",
                "Pd"
            ],
            "chemical_system": "In-Pd-Y",
            "density": 6.7868543490909286,
            "density_atomic": 0.04026228786028175,
            "volume": 546.4170361193688,
            "volume_molar": 14.957274114422015,
            "formula_full": "Y10 In8 Pd4",
            "formula_reduced": "Y5(In2Pd)2",
            "formula_anonymous": "A2B4C5",
            "energy": -122.87258754,
            "energy_per_atom": -5.585117615454545,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -122.87258754,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.095686,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:38:08.390000Z",
            "spacegroup": 55
        },
        {
            "id": "mp-1104365",
            "created_at": "2022-09-04T14:44:26.896642Z",
            "structure_string": "Y10 Ir4\n1.0\n0.000000 6.549304 0.000000\n-0.009876 0.000000 7.231263\n7.836272 -3.274652 -0.916517\nY Ir\n10 4\ndirect\n0.970097 0.918458 0.181747 Y\n0.788349 0.581542 0.818253 Y\n0.029903 0.081542 0.818253 Y\n0.211651 0.418458 0.181747 Y\n0.653865 0.818946 0.442568 Y\n0.211296 0.681054 0.557432 Y\n0.346135 0.181054 0.557432 Y\n0.788704 0.318946 0.442568 Y\n0.427241 0.750000 0.000000 Y\n0.572759 0.250000 0.000000 Y\n0.827800 0.573239 0.218674 Ir\n0.609125 0.926761 0.781326 Ir\n0.172200 0.426761 0.781326 Ir\n0.390875 0.073239 0.218674 Ir\n",
            "nsites": 14,
            "nelements": 2,
            "elements": [
                "Y",
                "Ir"
            ],
            "chemical_system": "Ir-Y",
            "density": 7.419334287556518,
            "density_atomic": 0.0377292875268236,
            "volume": 371.0645208989625,
            "volume_molar": 15.96144839925367,
            "formula_full": "Y10 Ir4",
            "formula_reduced": "Y5Ir2",
            "formula_anonymous": "A2B5",
            "energy": -109.01457137,
            "energy_per_atom": -7.786755097857143,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -109.01457137,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0177213,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:38.137000Z",
            "spacegroup": 15
        },
        {
            "id": "mp-1189119",
            "created_at": "2022-09-04T14:45:28.009128Z",
            "structure_string": "Y10 Ir6\n1.0\n8.350008 0.000000 0.000000\n-4.175004 7.231319 0.000000\n0.000000 0.000000 6.248806\nY Ir\n10 6\ndirect\n0.666667 0.333333 0.500000 Y\n0.333333 0.666667 0.500000 Y\n0.333333 0.666667 0.000000 Y\n0.666667 0.333333 0.000000 Y\n0.741457 0.741457 0.250000 Y\n0.258543 0.000000 0.250000 Y\n0.000000 0.258543 0.250000 Y\n0.258543 0.258543 0.750000 Y\n0.741457 0.000000 0.750000 Y\n0.000000 0.741457 0.750000 Y\n0.390976 0.390976 0.250000 Ir\n0.609024 0.000000 0.250000 Ir\n0.000000 0.609024 0.250000 Ir\n0.609024 0.609024 0.750000 Ir\n0.390976 0.000000 0.750000 Ir\n0.000000 0.390976 0.750000 Ir\n",
            "nsites": 16,
            "nelements": 2,
            "elements": [
                "Y",
                "Ir"
            ],
            "chemical_system": "Ir-Y",
            "density": 8.98835147106936,
            "density_atomic": 0.042405142698628266,
            "volume": 377.31272628207836,
            "volume_molar": 14.20143967631267,
            "formula_full": "Y10 Ir6",
            "formula_reduced": "Y5Ir3",
            "formula_anonymous": "A3B5",
            "energy": -129.51981361,
            "energy_per_atom": -8.094988350625,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -129.51981361,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0030658,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:57.655000Z",
            "spacegroup": 193
        },
        {
            "id": "mp-646125",
            "created_at": "2022-09-04T14:39:23.051771Z",
            "structure_string": "Y10 Mg16 Cu10\n1.0\n4.005862 0.000000 0.000000\n0.000000 7.417745 0.000000\n0.000000 0.000000 26.390546\nY Mg Cu\n10 16 10\ndirect\n0.500000 0.427030 0.149979 Y\n0.500000 0.572970 0.850021 Y\n0.500000 0.801385 0.250000 Y\n0.500000 0.924130 0.394363 Y\n0.500000 0.075870 0.894363 Y\n0.500000 0.198615 0.750000 Y\n0.500000 0.075870 0.605637 Y\n0.500000 0.924130 0.105637 Y\n0.500000 0.572970 0.649979 Y\n0.500000 0.427030 0.350021 Y\n0.000000 0.905562 0.810028 Mg\n0.500000 0.299761 0.023557 Mg\n0.000000 0.597240 0.438713 Mg\n0.000000 0.460904 0.250000 Mg\n0.000000 0.094438 0.310028 Mg\n0.500000 0.700239 0.976443 Mg\n0.000000 0.402760 0.938713 Mg\n0.000000 0.597240 0.061287 Mg\n0.000000 0.000000 0.000000 Mg\n0.500000 0.299761 0.476443 Mg\n0.000000 0.402760 0.561287 Mg\n0.500000 0.700239 0.523557 Mg\n0.000000 0.094438 0.189972 Mg\n0.000000 0.539096 0.750000 Mg\n0.000000 0.000000 0.500000 Mg\n0.000000 0.905562 0.689972 Mg\n0.500000 0.217642 0.250000 Cu\n0.000000 0.216310 0.088831 Cu\n0.000000 0.216310 0.411169 Cu\n0.000000 0.283176 0.832861 Cu\n0.000000 0.783690 0.911169 Cu\n0.500000 0.782358 0.750000 Cu\n0.000000 0.716824 0.167139 Cu\n0.000000 0.783690 0.588831 Cu\n0.000000 0.716824 0.332861 Cu\n0.000000 0.283176 0.667139 Cu\n",
            "nsites": 36,
            "nelements": 3,
            "elements": [
                "Y",
                "Mg",
                "Cu"
            ],
            "chemical_system": "Cu-Mg-Y",
            "density": 4.051709200693787,
            "density_atomic": 0.045907774716531784,
            "volume": 784.1808979479044,
            "volume_molar": 13.117910413181876,
            "formula_full": "Y10 Mg16 Cu10",
            "formula_reduced": "Y5Mg8Cu5",
            "formula_anonymous": "A5B5C8",
            "energy": -138.13986157,
            "energy_per_atom": -3.837218376944444,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -138.13986157,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0005064,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:28.090000Z",
            "spacegroup": 51
        },
        {
            "id": "mp-568046",
            "created_at": "2022-09-04T14:39:22.350024Z",
            "structure_string": "Y10 Mg26 Cu10\n1.0\n2.077038 -9.523674 0.000000\n2.077038 9.523674 0.000000\n0.000000 0.000000 25.547927\nY Mg Cu\n10 26 10\ndirect\n0.674775 0.325225 0.356178 Y\n0.325225 0.674775 0.856178 Y\n0.555609 0.444391 0.750000 Y\n0.515770 0.484230 0.605995 Y\n0.484230 0.515770 0.105995 Y\n0.484230 0.515770 0.394005 Y\n0.674775 0.325225 0.143822 Y\n0.515770 0.484230 0.894005 Y\n0.444391 0.555609 0.250000 Y\n0.325225 0.674775 0.643822 Y\n0.383070 0.616930 0.982981 Mg\n0.685490 0.314510 0.657681 Mg\n0.946610 0.053390 0.810980 Mg\n0.149781 0.850219 0.929026 Mg\n0.232791 0.767209 0.045806 Mg\n0.767209 0.232791 0.954194 Mg\n0.806640 0.193360 0.750000 Mg\n0.850219 0.149781 0.429026 Mg\n0.314510 0.685490 0.157681 Mg\n0.805641 0.194359 0.250000 Mg\n0.149781 0.850219 0.570974 Mg\n0.616930 0.383070 0.017019 Mg\n0.053390 0.946610 0.189020 Mg\n0.850219 0.149781 0.070974 Mg\n0.053390 0.946610 0.310980 Mg\n0.000000 0.000000 0.500000 Mg\n0.193360 0.806640 0.250000 Mg\n0.616930 0.383070 0.482981 Mg\n0.767209 0.232791 0.545806 Mg\n0.383070 0.616930 0.517019 Mg\n0.232791 0.767209 0.454194 Mg\n0.194359 0.805641 0.750000 Mg\n0.000000 0.000000 0.000000 Mg\n0.314510 0.685490 0.342319 Mg\n0.946610 0.053390 0.689020 Mg\n0.685490 0.314510 0.842319 Mg\n0.906671 0.093329 0.170570 Cu\n0.904379 0.095621 0.914602 Cu\n0.399629 0.600371 0.750000 Cu\n0.600371 0.399629 0.250000 Cu\n0.093329 0.906671 0.829430 Cu\n0.095621 0.904379 0.414602 Cu\n0.906671 0.093329 0.329430 Cu\n0.093329 0.906671 0.670570 Cu\n0.095621 0.904379 0.085398 Cu\n0.904379 0.095621 0.585398 Cu\n",
            "nsites": 46,
            "nelements": 3,
            "elements": [
                "Y",
                "Mg",
                "Cu"
            ],
            "chemical_system": "Cu-Mg-Y",
            "density": 3.5428565087158566,
            "density_atomic": 0.045511715553872026,
            "volume": 1010.7287637959943,
            "volume_molar": 13.232067142957108,
            "formula_full": "Y10 Mg26 Cu10",
            "formula_reduced": "Y5Mg13Cu5",
            "formula_anonymous": "A5B5C13",
            "energy": -154.96054587,
            "energy_per_atom": -3.3687075189130438,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -154.96054587,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 4.94e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:34.317000Z",
            "spacegroup": 63
        },
        {
            "id": "mp-571074",
            "created_at": "2022-09-04T14:46:23.347378Z",
            "structure_string": "Y10 Mg32 Cu10\n1.0\n2.076798 -9.546019 0.000000\n2.076798 9.546019 0.000000\n0.000000 0.000000 28.892828\nY Mg Cu\n10 32 10\ndirect\n0.396031 0.603969 0.656701 Y\n0.587819 0.412181 0.622786 Y\n0.412181 0.587819 0.122786 Y\n0.412181 0.587819 0.377214 Y\n0.627519 0.372481 0.750000 Y\n0.603969 0.396031 0.156701 Y\n0.603969 0.396031 0.343299 Y\n0.372481 0.627519 0.250000 Y\n0.396031 0.603969 0.843299 Y\n0.587819 0.412181 0.877214 Y\n0.925214 0.074786 0.032347 Mg\n0.453273 0.546727 0.546033 Mg\n0.756796 0.243204 0.831762 Mg\n0.161709 0.838291 0.070261 Mg\n0.018085 0.981915 0.695876 Mg\n0.691470 0.308530 0.988689 Mg\n0.074786 0.925214 0.967653 Mg\n0.221734 0.778266 0.909446 Mg\n0.122036 0.877964 0.250000 Mg\n0.838291 0.161709 0.929739 Mg\n0.018085 0.981915 0.804124 Mg\n0.308530 0.691470 0.011311 Mg\n0.308530 0.691470 0.488689 Mg\n0.546727 0.453273 0.046033 Mg\n0.243204 0.756796 0.168238 Mg\n0.877964 0.122036 0.750000 Mg\n0.265853 0.734147 0.750000 Mg\n0.981915 0.018085 0.195876 Mg\n0.778266 0.221734 0.090554 Mg\n0.546727 0.453273 0.453967 Mg\n0.243204 0.756796 0.331762 Mg\n0.778266 0.221734 0.409446 Mg\n0.838291 0.161709 0.570261 Mg\n0.221734 0.778266 0.590554 Mg\n0.074786 0.925214 0.532347 Mg\n0.981915 0.018085 0.304124 Mg\n0.691470 0.308530 0.511311 Mg\n0.161709 0.838291 0.429739 Mg\n0.925214 0.074786 0.467653 Mg\n0.756796 0.243204 0.668238 Mg\n0.453273 0.546727 0.953967 Mg\n0.734147 0.265853 0.250000 Mg\n0.024554 0.975446 0.104213 Cu\n0.834689 0.165311 0.179078 Cu\n0.165311 0.834689 0.679078 Cu\n0.471388 0.528612 0.750000 Cu\n0.975446 0.024554 0.604213 Cu\n0.528612 0.471388 0.250000 Cu\n0.975446 0.024554 0.895787 Cu\n0.834689 0.165311 0.320922 Cu\n0.165311 0.834689 0.820922 Cu\n0.024554 0.975446 0.395787 Cu\n",
            "nsites": 52,
            "nelements": 3,
            "elements": [
                "Y",
                "Mg",
                "Cu"
            ],
            "chemical_system": "Cu-Mg-Y",
            "density": 3.337108722153248,
            "density_atomic": 0.04539068579605497,
            "volume": 1145.6094810649338,
            "volume_molar": 13.267349136468434,
            "formula_full": "Y10 Mg32 Cu10",
            "formula_reduced": "Y5Mg16Cu5",
            "formula_anonymous": "A5B5C16",
            "energy": -164.6777765,
            "energy_per_atom": -3.166880317307692,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -164.6777765,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0005068,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:31.025000Z",
            "spacegroup": 63
        },
        {
            "id": "mp-1197605",
            "created_at": "2022-09-04T14:45:00.624619Z",
            "structure_string": "Y10 Mn13 C18\n1.0\n-5.049092 5.049092 5.049092\n5.049092 -5.049092 5.049092\n5.049092 5.049092 -5.049092\nY Mn C\n10 13 18\ndirect\n0.500000 0.750000 0.250000 Y\n0.750000 0.500000 0.250000 Y\n0.250000 0.750000 0.500000 Y\n0.250000 0.500000 0.750000 Y\n0.500000 0.250000 0.750000 Y\n0.750000 0.250000 0.500000 Y\n0.408613 0.000000 0.000000 Y\n0.000000 0.408613 0.000000 Y\n0.000000 0.000000 0.408613 Y\n0.591387 0.591387 0.591387 Y\n0.000000 0.000000 0.000000 Mn\n0.666254 0.819809 0.000000 Mn\n0.846445 0.180191 0.180191 Mn\n0.666254 0.000000 0.819809 Mn\n0.819809 0.666254 0.000000 Mn\n0.000000 0.666254 0.819809 Mn\n0.180191 0.846445 0.180191 Mn\n0.180191 0.180191 0.846445 Mn\n0.000000 0.819809 0.666254 Mn\n0.819809 0.000000 0.666254 Mn\n0.333746 0.333746 0.153555 Mn\n0.153555 0.333746 0.333746 Mn\n0.333746 0.153555 0.333746 Mn\n0.703316 0.217991 0.000000 C\n0.485324 0.782009 0.782009 C\n0.703316 0.000000 0.217991 C\n0.217991 0.703316 0.000000 C\n0.000000 0.703316 0.217991 C\n0.782009 0.485324 0.782009 C\n0.782009 0.782009 0.485324 C\n0.000000 0.217991 0.703316 C\n0.217991 0.000000 0.703316 C\n0.296684 0.296684 0.514676 C\n0.514676 0.296684 0.296684 C\n0.296684 0.514676 0.296684 C\n0.568817 0.568817 0.000000 C\n0.000000 0.431183 0.431183 C\n0.568817 0.000000 0.568817 C\n0.000000 0.568817 0.568817 C\n0.431183 0.000000 0.431183 C\n0.431183 0.431183 0.000000 C\n",
            "nsites": 41,
            "nelements": 3,
            "elements": [
                "Y",
                "Mn",
                "C"
            ],
            "chemical_system": "C-Mn-Y",
            "density": 5.867976274221824,
            "density_atomic": 0.07963133802417206,
            "volume": 514.872674719524,
            "volume_molar": 7.562526147899188,
            "formula_full": "Y10 Mn13 C18",
            "formula_reduced": "Y10Mn13C18",
            "formula_anonymous": "A10B13C18",
            "energy": -362.41112505000007,
            "energy_per_atom": -8.83929573292683,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -362.41112505000007,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 6.0813327,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:52.124000Z",
            "spacegroup": 217
        },
        {
            "id": "mp-1324685",
            "created_at": "2022-09-04T14:45:39.683275Z",
            "structure_string": "Y10 Mn6 Ni6 O36\n1.0\n5.516173 0.000000 0.000000\n0.000000 7.483117 0.000000\n0.000000 7.495450 15.848416\nY Mn Ni O\n10 6 6 36\ndirect\n0.813378 0.748294 0.504650 Y\n0.815667 0.079187 0.170977 Y\n0.320076 0.255101 0.991512 Y\n0.315423 0.586781 0.663618 Y\n0.323939 0.924212 0.327311 Y\n0.676061 0.924212 0.827311 Y\n0.679924 0.255101 0.491512 Y\n0.684577 0.586781 0.163618 Y\n0.184333 0.079187 0.670977 Y\n0.186622 0.748294 0.004650 Y\n0.230490 0.178572 0.831796 Mn\n0.243532 0.499714 0.496066 Mn\n0.246622 0.824491 0.170421 Mn\n0.756468 0.499714 0.996066 Mn\n0.753378 0.824491 0.670421 Mn\n0.769510 0.178572 0.331796 Mn\n0.230681 0.660960 0.833957 Ni\n0.248068 0.006598 0.496550 Ni\n0.250319 0.334565 0.167486 Ni\n0.751932 0.006598 0.996550 Ni\n0.749681 0.334565 0.667486 Ni\n0.769319 0.660960 0.333957 Ni\n0.066178 0.095453 0.937466 O\n0.057763 0.452479 0.598744 O\n0.052688 0.808452 0.260943 O\n0.554344 0.552158 0.905014 O\n0.549328 0.878146 0.570739 O\n0.562263 0.219943 0.234093 O\n0.437737 0.219943 0.734093 O\n0.445656 0.552158 0.405014 O\n0.450672 0.878146 0.070739 O\n0.947312 0.808452 0.760943 O\n0.933822 0.095453 0.437466 O\n0.942237 0.452479 0.098744 O\n0.070186 0.521869 0.944367 O\n0.041953 0.843952 0.604466 O\n0.038237 0.170779 0.264448 O\n0.513379 0.131697 0.900001 O\n0.538462 0.489398 0.564222 O\n0.550467 0.818759 0.232161 O\n0.449533 0.818759 0.732161 O\n0.486621 0.131697 0.400001 O\n0.461538 0.489398 0.064222 O\n0.961763 0.170779 0.764448 O\n0.929814 0.521869 0.444367 O\n0.958047 0.843952 0.104466 O\n0.779742 0.780428 0.965170 O\n0.773182 0.114461 0.631329 O\n0.785711 0.448231 0.300789 O\n0.273298 0.882526 0.863819 O\n0.277686 0.221408 0.532311 O\n0.279620 0.559808 0.195873 O\n0.720380 0.559808 0.695873 O\n0.726702 0.882526 0.363819 O\n0.722314 0.221408 0.032311 O\n0.214289 0.448231 0.800789 O\n0.220258 0.780428 0.465170 O\n0.226818 0.114461 0.131329 O\n",
            "nsites": 58,
            "nelements": 4,
            "elements": [
                "Y",
                "Mn",
                "Ni",
                "O"
            ],
            "chemical_system": "Mn-Ni-O-Y",
            "density": 5.44928573325219,
            "density_atomic": 0.08865877318713965,
            "volume": 654.1935774091352,
            "volume_molar": 6.792492771458221,
            "formula_full": "Y10 Mn6 Ni6 O36",
            "formula_reduced": "Y5Mn3(NiO6)3",
            "formula_anonymous": "A3B3C5D18",
            "energy": -477.46927454,
            "energy_per_atom": -8.232228871379311,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -427.48327454,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 24.0000014,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:05.615000Z",
            "spacegroup": 7
        },
        {
            "id": "mp-1189582",
            "created_at": "2022-09-04T14:45:29.662440Z",
            "structure_string": "Y10 Ni4 Bi2\n1.0\n-3.856727 3.856727 6.826657\n3.856727 -3.856727 6.826657\n3.856727 3.856727 -6.826657\nY Ni Bi\n10 4 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.000000 Y\n0.018760 0.518760 0.809945 Y\n0.708814 0.208814 0.190055 Y\n0.518760 0.708814 0.500000 Y\n0.208814 0.018760 0.500000 Y\n0.981240 0.481240 0.190055 Y\n0.291186 0.791186 0.809945 Y\n0.481240 0.291186 0.500000 Y\n0.791186 0.981240 0.500000 Y\n0.368058 0.868058 0.236115 Ni\n0.631942 0.131942 0.763885 Ni\n0.868058 0.631942 0.500000 Ni\n0.131942 0.368058 0.500000 Ni\n0.750000 0.750000 0.000000 Bi\n0.250000 0.250000 0.000000 Bi\n",
            "nsites": 16,
            "nelements": 3,
            "elements": [
                "Y",
                "Ni",
                "Bi"
            ],
            "chemical_system": "Bi-Ni-Y",
            "density": 6.30331873686634,
            "density_atomic": 0.039392551569459144,
            "volume": 406.16815521045663,
            "volume_molar": 15.287511268168108,
            "formula_full": "Y10 Ni4 Bi2",
            "formula_reduced": "Y5Ni2Bi",
            "formula_anonymous": "AB2C5",
            "energy": -102.91039412,
            "energy_per_atom": -6.4318996325,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -102.91039412,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0132334,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:56.458000Z",
            "spacegroup": 140
        }
    ]
}