GET /third-parties/MatprojStructure/?format=api&ordering=formula_anonymous&page=142
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_anonymous&page=143",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=formula_anonymous&page=141",
    "results": [
        {
            "id": "mp-1201182",
            "created_at": "2022-09-04T14:47:13.366320Z",
            "structure_string": "Eu4 Ni34\n1.0\n0.000000 0.000000 -8.153786\n-4.168754 -7.249752 0.000000\n-4.168754 7.249752 0.000000\nEu Ni\n4 34\ndirect\n0.750000 0.000561 0.999439 Eu\n0.250000 0.999439 0.000561 Eu\n0.250000 0.666876 0.333124 Eu\n0.750000 0.333124 0.666876 Eu\n0.605681 0.666295 0.333705 Ni\n0.394319 0.333705 0.666295 Ni\n0.105681 0.333705 0.666295 Ni\n0.894319 0.666295 0.333705 Ni\n0.500000 0.500000 0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n0.500000 0.000000 0.500000 Ni\n0.000000 0.500000 0.000000 Ni\n0.000000 0.500000 0.500000 Ni\n0.000000 0.000000 0.500000 Ni\n0.750000 0.669348 0.042661 Ni\n0.750000 0.373548 0.330905 Ni\n0.750000 0.958139 0.627031 Ni\n0.750000 0.372969 0.041861 Ni\n0.750000 0.957339 0.330652 Ni\n0.750000 0.669095 0.626452 Ni\n0.250000 0.330652 0.957339 Ni\n0.250000 0.626452 0.669095 Ni\n0.250000 0.041861 0.372969 Ni\n0.250000 0.627031 0.958139 Ni\n0.250000 0.042661 0.669348 Ni\n0.250000 0.330905 0.373548 Ni\n0.487178 0.832335 0.664837 Ni\n0.487711 0.832528 0.167472 Ni\n0.487178 0.335163 0.167665 Ni\n0.512822 0.167665 0.335163 Ni\n0.512289 0.167472 0.832528 Ni\n0.512822 0.664837 0.832335 Ni\n0.987178 0.167665 0.335163 Ni\n0.987711 0.167472 0.832528 Ni\n0.987178 0.664837 0.832335 Ni\n0.012822 0.832335 0.664837 Ni\n0.012289 0.832528 0.167472 Ni\n0.012822 0.335163 0.167665 Ni\n",
            "nsites": 38,
            "nelements": 2,
            "elements": [
                "Eu",
                "Ni"
            ],
            "chemical_system": "Eu-Ni",
            "density": 8.771554100160952,
            "density_atomic": 0.07710186327723782,
            "volume": 492.8544964388486,
            "volume_molar": 7.810629346720172,
            "formula_full": "Eu4 Ni34",
            "formula_reduced": "Eu2Ni17",
            "formula_anonymous": "A2B17",
            "energy": -240.07640542,
            "energy_per_atom": -6.317800142631579,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -240.07640542,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 42.6023121,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:38:02.706000Z",
            "spacegroup": 194
        },
        {
            "id": "mp-581734",
            "created_at": "2022-09-04T14:47:33.554448Z",
            "structure_string": "Gd2 Fe17\n1.0\n4.804283 -4.266600 0.000000\n4.804283 4.266600 0.000000\n1.015190 0.000000 6.344636\nGd Fe\n2 17\ndirect\n0.340675 0.340675 0.340675 Gd\n0.659325 0.659325 0.659325 Gd\n0.656341 0.656341 0.154884 Fe\n0.293357 0.706643 0.000000 Fe\n0.706643 0.293357 0.000000 Fe\n0.343659 0.845116 0.343659 Fe\n0.096913 0.096913 0.096913 Fe\n0.343659 0.343659 0.845116 Fe\n0.656341 0.154884 0.656341 Fe\n0.000000 0.000000 0.500000 Fe\n0.154884 0.656341 0.656341 Fe\n0.706643 0.000000 0.293357 Fe\n0.293357 0.000000 0.706643 Fe\n0.903087 0.903087 0.903087 Fe\n0.845116 0.343659 0.343659 Fe\n0.000000 0.500000 0.000000 Fe\n0.000000 0.706643 0.293357 Fe\n0.500000 0.000000 0.000000 Fe\n0.000000 0.293357 0.706643 Fe\n",
            "nsites": 19,
            "nelements": 2,
            "elements": [
                "Gd",
                "Fe"
            ],
            "chemical_system": "Fe-Gd",
            "density": 8.068681393531563,
            "density_atomic": 0.073047672592279,
            "volume": 260.10411181818085,
            "volume_molar": 8.244124071704551,
            "formula_full": "Gd2 Fe17",
            "formula_reduced": "Gd2Fe17",
            "formula_anonymous": "A2B17",
            "energy": -172.24485521999998,
            "energy_per_atom": -9.065518695789473,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -172.24485521999998,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 26.2055096,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:38:11.105000Z",
            "spacegroup": 166
        },
        {
            "id": "mp-1023",
            "created_at": "2022-09-04T14:47:59.890442Z",
            "structure_string": "Ho4 Co34\n1.0\n4.139856 -7.170440 0.000000\n4.139856 7.170440 0.000000\n0.000000 0.000000 8.081978\nHo Co\n4 34\ndirect\n0.000000 0.000000 0.250000 Ho\n0.000000 0.000000 0.750000 Ho\n0.333333 0.666667 0.750000 Ho\n0.666667 0.333333 0.250000 Ho\n0.333333 0.666667 0.106450 Co\n0.666667 0.333333 0.606450 Co\n0.666667 0.333333 0.893550 Co\n0.333333 0.666667 0.393550 Co\n0.500000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.000000 0.500000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.500000 0.500000 0.000000 Co\n0.500000 0.000000 0.500000 Co\n0.328334 0.953928 0.250000 Co\n0.374407 0.328334 0.750000 Co\n0.953928 0.625593 0.750000 Co\n0.046072 0.374407 0.250000 Co\n0.625593 0.671666 0.250000 Co\n0.374407 0.046072 0.750000 Co\n0.671666 0.625593 0.750000 Co\n0.671666 0.046072 0.750000 Co\n0.953928 0.328334 0.750000 Co\n0.046072 0.671666 0.250000 Co\n0.625593 0.953928 0.250000 Co\n0.328334 0.374407 0.250000 Co\n0.166567 0.333134 0.978039 Co\n0.833433 0.166567 0.478039 Co\n0.333134 0.166567 0.478039 Co\n0.666866 0.833433 0.978039 Co\n0.166567 0.833433 0.978039 Co\n0.833433 0.666866 0.021961 Co\n0.833433 0.166567 0.021961 Co\n0.833433 0.666866 0.478039 Co\n0.333134 0.166567 0.021961 Co\n0.666866 0.833433 0.521961 Co\n0.166567 0.333134 0.521961 Co\n0.166567 0.833433 0.521961 Co\n",
            "nsites": 38,
            "nelements": 2,
            "elements": [
                "Ho",
                "Co"
            ],
            "chemical_system": "Co-Ho",
            "density": 9.217537868031132,
            "density_atomic": 0.07919630070316101,
            "volume": 479.82039138961045,
            "volume_molar": 7.604068253859278,
            "formula_full": "Ho4 Co34",
            "formula_reduced": "Ho2Co17",
            "formula_anonymous": "A2B17",
            "energy": -263.91017543,
            "energy_per_atom": -6.945004616578947,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -263.91017543,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 50.4351661,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:38:31.181000Z",
            "spacegroup": 194
        },
        {
            "id": "mp-1105643",
            "created_at": "2022-09-04T14:47:57.333684Z",
            "structure_string": "Hf2 Be17\n1.0\n4.235659 -3.734443 0.000000\n4.235659 3.734443 0.000000\n0.943123 0.000000 5.567530\nHf Be\n2 17\ndirect\n0.837466 0.837466 0.837466 Hf\n0.162534 0.162534 0.162534 Hf\n0.596436 0.596436 0.596436 Be\n0.403564 0.403564 0.403564 Be\n0.500000 0.500000 0.000000 Be\n0.000000 0.500000 0.500000 Be\n0.500000 0.000000 0.500000 Be\n0.211114 0.500000 0.788886 Be\n0.788886 0.211114 0.500000 Be\n0.500000 0.788886 0.211114 Be\n0.788886 0.500000 0.211114 Be\n0.211114 0.788886 0.500000 Be\n0.500000 0.211114 0.788886 Be\n0.843143 0.339747 0.843143 Be\n0.843143 0.843143 0.339747 Be\n0.339747 0.843143 0.843143 Be\n0.156857 0.660253 0.156857 Be\n0.156857 0.156857 0.660253 Be\n0.660253 0.156857 0.156857 Be\n",
            "nsites": 19,
            "nelements": 2,
            "elements": [
                "Hf",
                "Be"
            ],
            "chemical_system": "Be-Hf",
            "density": 4.809934695689453,
            "density_atomic": 0.1078733622539136,
            "volume": 176.13245386082966,
            "volume_molar": 5.582602260811167,
            "formula_full": "Hf2 Be17",
            "formula_reduced": "Hf2Be17",
            "formula_anonymous": "A2B17",
            "energy": -87.7840476,
            "energy_per_atom": -4.620213031578947,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -87.7840476,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0013929,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:38:20.368000Z",
            "spacegroup": 166
        },
        {
            "id": "mp-1105910",
            "created_at": "2022-09-04T14:45:19.951292Z",
            "structure_string": "Pu2 Zn17\n1.0\n5.125767 -4.506503 0.000000\n5.125767 4.506503 0.000000\n1.163711 0.000000 6.725164\nPu Zn\n2 17\ndirect\n0.665068 0.665068 0.665068 Pu\n0.334932 0.334932 0.334932 Pu\n0.000000 0.000000 0.500000 Zn\n0.500000 0.000000 0.000000 Zn\n0.000000 0.500000 0.000000 Zn\n0.699383 0.300617 0.000000 Zn\n0.000000 0.699383 0.300617 Zn\n0.300617 0.000000 0.699383 Zn\n0.000000 0.300617 0.699383 Zn\n0.699383 0.000000 0.300617 Zn\n0.300617 0.699383 0.000000 Zn\n0.352189 0.352189 0.837808 Zn\n0.837808 0.352189 0.352189 Zn\n0.352189 0.837808 0.352189 Zn\n0.647811 0.647811 0.162192 Zn\n0.162192 0.647811 0.647811 Zn\n0.647811 0.162192 0.647811 Zn\n0.898452 0.898452 0.898452 Zn\n0.101548 0.101548 0.101548 Zn\n",
            "nsites": 19,
            "nelements": 2,
            "elements": [
                "Pu",
                "Zn"
            ],
            "chemical_system": "Pu-Zn",
            "density": 8.55115782504287,
            "density_atomic": 0.06115362425786337,
            "volume": 310.6929512449445,
            "volume_molar": 9.847561502825647,
            "formula_full": "Pu2 Zn17",
            "formula_reduced": "Pu2Zn17",
            "formula_anonymous": "A2B17",
            "energy": -52.95628298,
            "energy_per_atom": -2.7871727884210524,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -52.95628298,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 10.9175789,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:02.199000Z",
            "spacegroup": 166
        },
        {
            "id": "mp-580102",
            "created_at": "2022-09-04T14:45:58.325298Z",
            "structure_string": "Gd4 Ni34\n1.0\n4.145002 -7.179353 0.000000\n4.145002 7.179353 0.000000\n0.000000 0.000000 8.011013\nGd Ni\n4 34\ndirect\n0.000000 0.000000 0.250000 Gd\n0.000000 0.000000 0.750000 Gd\n0.666667 0.333333 0.250000 Gd\n0.333333 0.666667 0.750000 Gd\n0.043889 0.672040 0.250000 Ni\n0.331734 0.165867 0.020524 Ni\n0.834133 0.668266 0.020524 Ni\n0.500000 0.000000 0.000000 Ni\n0.666667 0.333333 0.602285 Ni\n0.165867 0.834133 0.520524 Ni\n0.672040 0.043889 0.750000 Ni\n0.371849 0.327960 0.750000 Ni\n0.956111 0.628151 0.750000 Ni\n0.165867 0.331734 0.979476 Ni\n0.333333 0.666667 0.397715 Ni\n0.668266 0.834133 0.520524 Ni\n0.165867 0.834133 0.979476 Ni\n0.327960 0.956111 0.250000 Ni\n0.000000 0.500000 0.500000 Ni\n0.834133 0.668266 0.479476 Ni\n0.371849 0.043889 0.750000 Ni\n0.333333 0.666667 0.102285 Ni\n0.956111 0.327960 0.750000 Ni\n0.668266 0.834133 0.979476 Ni\n0.628151 0.672040 0.250000 Ni\n0.165867 0.331734 0.520524 Ni\n0.000000 0.500000 0.000000 Ni\n0.834133 0.165867 0.479476 Ni\n0.672040 0.628151 0.750000 Ni\n0.628151 0.956111 0.250000 Ni\n0.834133 0.165867 0.020524 Ni\n0.331734 0.165867 0.479476 Ni\n0.666667 0.333333 0.897715 Ni\n0.043889 0.371849 0.250000 Ni\n0.327960 0.371849 0.250000 Ni\n0.500000 0.500000 0.000000 Ni\n0.500000 0.000000 0.500000 Ni\n0.500000 0.500000 0.500000 Ni\n",
            "nsites": 38,
            "nelements": 2,
            "elements": [
                "Gd",
                "Ni"
            ],
            "chemical_system": "Gd-Ni",
            "density": 9.140726198468641,
            "density_atomic": 0.07969959462105765,
            "volume": 476.7903799345036,
            "volume_molar": 7.556049423630159,
            "formula_full": "Gd4 Ni34",
            "formula_reduced": "Gd2Ni17",
            "formula_anonymous": "A2B17",
            "energy": -237.49348854,
            "energy_per_atom": -6.249828645789473,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -237.49348854,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 5.2379734,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:11.894000Z",
            "spacegroup": 194
        },
        {
            "id": "mp-1197654",
            "created_at": "2022-09-04T14:46:18.769828Z",
            "structure_string": "Dy4 Ni34\n1.0\n4.114069 -7.125777 0.000000\n4.114069 7.125777 0.000000\n0.000000 0.000000 8.039074\nDy Ni\n4 34\ndirect\n0.000000 0.000000 0.250000 Dy\n0.000000 0.000000 0.750000 Dy\n0.333333 0.666667 0.750000 Dy\n0.666667 0.333333 0.250000 Dy\n0.333333 0.666667 0.397677 Ni\n0.666667 0.333333 0.602323 Ni\n0.666667 0.333333 0.897677 Ni\n0.333333 0.666667 0.102323 Ni\n0.500000 0.500000 0.500000 Ni\n0.500000 0.000000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n0.500000 0.500000 0.000000 Ni\n0.500000 0.000000 0.000000 Ni\n0.000000 0.500000 0.000000 Ni\n0.328089 0.369691 0.250000 Ni\n0.630309 0.958398 0.250000 Ni\n0.041602 0.671911 0.250000 Ni\n0.630309 0.671911 0.250000 Ni\n0.041602 0.369691 0.250000 Ni\n0.328089 0.958398 0.250000 Ni\n0.671911 0.630309 0.750000 Ni\n0.369691 0.041602 0.750000 Ni\n0.958398 0.328089 0.750000 Ni\n0.369691 0.328089 0.750000 Ni\n0.958398 0.630309 0.750000 Ni\n0.671911 0.041602 0.750000 Ni\n0.165615 0.834385 0.519718 Ni\n0.165615 0.331230 0.519718 Ni\n0.668770 0.834385 0.519718 Ni\n0.834385 0.165615 0.480282 Ni\n0.834385 0.668770 0.480282 Ni\n0.331230 0.165615 0.480282 Ni\n0.834385 0.165615 0.019718 Ni\n0.834385 0.668770 0.019718 Ni\n0.331230 0.165615 0.019718 Ni\n0.165615 0.834385 0.980282 Ni\n0.165615 0.331230 0.980282 Ni\n0.668770 0.834385 0.980282 Ni\n",
            "nsites": 38,
            "nelements": 2,
            "elements": [
                "Dy",
                "Ni"
            ],
            "chemical_system": "Dy-Ni",
            "density": 9.320290599499547,
            "density_atomic": 0.08062018237090385,
            "volume": 471.3459940486857,
            "volume_molar": 7.469768217956073,
            "formula_full": "Dy4 Ni34",
            "formula_reduced": "Dy2Ni17",
            "formula_anonymous": "A2B17",
            "energy": -222.588086,
            "energy_per_atom": -5.857581210526316,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -222.588086,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 14.2128934,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:27.149000Z",
            "spacegroup": 194
        },
        {
            "id": "mp-528",
            "created_at": "2022-09-04T14:42:40.872432Z",
            "structure_string": "U2 Zn17\n1.0\n5.098007 -4.469608 0.000000\n5.098007 4.469608 0.000000\n1.179339 0.000000 6.676544\nU Zn\n2 17\ndirect\n0.661700 0.661700 0.661700 U\n0.338300 0.338300 0.338300 U\n0.354146 0.354146 0.839694 Zn\n0.839694 0.354146 0.354146 Zn\n0.101735 0.101735 0.101735 Zn\n0.898265 0.898265 0.898265 Zn\n0.000000 0.000000 0.500000 Zn\n0.000000 0.500000 0.000000 Zn\n0.500000 0.000000 0.000000 Zn\n0.000000 0.701664 0.298336 Zn\n0.701664 0.298336 0.000000 Zn\n0.298336 0.000000 0.701664 Zn\n0.000000 0.298336 0.701664 Zn\n0.298336 0.701664 0.000000 Zn\n0.701664 0.000000 0.298336 Zn\n0.160306 0.645854 0.645854 Zn\n0.645854 0.645854 0.160306 Zn\n0.645854 0.160306 0.645854 Zn\n0.354146 0.839694 0.354146 Zn\n",
            "nsites": 19,
            "nelements": 2,
            "elements": [
                "U",
                "Zn"
            ],
            "chemical_system": "U-Zn",
            "density": 8.666644458967598,
            "density_atomic": 0.0624456264390851,
            "volume": 304.26470328605404,
            "volume_molar": 9.643815113096062,
            "formula_full": "U2 Zn17",
            "formula_reduced": "U2Zn17",
            "formula_anonymous": "A2B17",
            "energy": -44.37451267,
            "energy_per_atom": -2.335500666842105,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -44.37451267,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0814061,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:54.646000Z",
            "spacegroup": 166
        },
        {
            "id": "mp-1212567",
            "created_at": "2022-09-04T14:42:40.059627Z",
            "structure_string": "Hf12 Be102\n1.0\n3.738356 -6.475023 0.000000\n3.738356 6.475023 0.000000\n0.000000 0.000000 21.766557\nHf Be\n12 102\ndirect\n0.333333 0.666667 0.585820 Hf\n0.666667 0.333333 0.414180 Hf\n0.666667 0.333333 0.085820 Hf\n0.333333 0.666667 0.914180 Hf\n0.333333 0.666667 0.250000 Hf\n0.666667 0.333333 0.750000 Hf\n0.000000 0.000000 0.080505 Hf\n0.000000 0.000000 0.919495 Hf\n0.000000 0.000000 0.580505 Hf\n0.000000 0.000000 0.419495 Hf\n0.333333 0.666667 0.750000 Hf\n0.666667 0.333333 0.250000 Hf\n0.165346 0.330691 0.995553 Be\n0.834654 0.669309 0.004447 Be\n0.669309 0.834654 0.995553 Be\n0.834654 0.669309 0.495553 Be\n0.330691 0.165346 0.004447 Be\n0.165346 0.330691 0.504447 Be\n0.165346 0.834654 0.995553 Be\n0.330691 0.165346 0.495553 Be\n0.834654 0.165346 0.004447 Be\n0.669309 0.834654 0.504447 Be\n0.834654 0.165346 0.495553 Be\n0.165346 0.834654 0.504447 Be\n0.333333 0.666667 0.131240 Be\n0.666667 0.333333 0.868760 Be\n0.666667 0.333333 0.631240 Be\n0.333333 0.666667 0.368760 Be\n0.044675 0.378054 0.083247 Be\n0.955325 0.621946 0.916753 Be\n0.621946 0.666622 0.083247 Be\n0.955325 0.621946 0.583247 Be\n0.378054 0.044675 0.916753 Be\n0.378054 0.333378 0.916753 Be\n0.044675 0.378054 0.416753 Be\n0.621946 0.955325 0.083247 Be\n0.333378 0.955325 0.083247 Be\n0.378054 0.333378 0.583247 Be\n0.666622 0.621946 0.916753 Be\n0.666622 0.044675 0.916753 Be\n0.621946 0.666622 0.416753 Be\n0.333378 0.378054 0.083247 Be\n0.621946 0.955325 0.416753 Be\n0.378054 0.044675 0.583247 Be\n0.666622 0.044675 0.583247 Be\n0.333378 0.378054 0.416753 Be\n0.333378 0.955325 0.416753 Be\n0.666622 0.621946 0.583247 Be\n0.955325 0.333378 0.916753 Be\n0.044675 0.666622 0.083247 Be\n0.044675 0.666622 0.416753 Be\n0.955325 0.333378 0.583247 Be\n0.501835 0.003671 0.171060 Be\n0.498165 0.996329 0.828940 Be\n0.996329 0.498165 0.171060 Be\n0.498165 0.996329 0.671060 Be\n0.003671 0.501835 0.828940 Be\n0.501835 0.003671 0.328940 Be\n0.501835 0.498165 0.171060 Be\n0.003671 0.501835 0.671060 Be\n0.498165 0.501835 0.828940 Be\n0.996329 0.498165 0.328940 Be\n0.498165 0.501835 0.671060 Be\n0.501835 0.498165 0.328940 Be\n0.000000 0.000000 0.201433 Be\n0.000000 0.000000 0.798567 Be\n0.000000 0.000000 0.701433 Be\n0.000000 0.000000 0.298567 Be\n0.167706 0.335412 0.662656 Be\n0.832294 0.664588 0.337344 Be\n0.664588 0.832294 0.662656 Be\n0.832294 0.664588 0.162656 Be\n0.335412 0.167706 0.337344 Be\n0.167706 0.335412 0.837344 Be\n0.167706 0.832294 0.662656 Be\n0.335412 0.167706 0.162656 Be\n0.832294 0.167706 0.337344 Be\n0.664588 0.832294 0.837344 Be\n0.832294 0.167706 0.162656 Be\n0.167706 0.832294 0.837344 Be\n0.166576 0.333152 0.166335 Be\n0.833424 0.666848 0.833665 Be\n0.666848 0.833424 0.166335 Be\n0.833424 0.666848 0.666335 Be\n0.333152 0.166576 0.833665 Be\n0.166576 0.333152 0.333665 Be\n0.166576 0.833424 0.166335 Be\n0.333152 0.166576 0.666335 Be\n0.833424 0.166576 0.833665 Be\n0.666848 0.833424 0.333665 Be\n0.833424 0.166576 0.666335 Be\n0.166576 0.833424 0.333665 Be\n0.333333 0.666667 0.034802 Be\n0.666667 0.333333 0.965198 Be\n0.666667 0.333333 0.534802 Be\n0.333333 0.666667 0.465198 Be\n0.998780 0.287560 0.250000 Be\n0.001220 0.712440 0.750000 Be\n0.712440 0.711219 0.250000 Be\n0.287560 0.998780 0.750000 Be\n0.287560 0.288781 0.750000 Be\n0.712440 0.001220 0.250000 Be\n0.288781 0.001220 0.250000 Be\n0.711219 0.712440 0.750000 Be\n0.711219 0.998780 0.750000 Be\n0.288781 0.287560 0.250000 Be\n0.001220 0.288781 0.750000 Be\n0.998780 0.711219 0.250000 Be\n0.500000 0.000000 0.000000 Be\n0.000000 0.500000 0.000000 Be\n0.500000 0.000000 0.500000 Be\n0.500000 0.500000 0.000000 Be\n0.000000 0.500000 0.500000 Be\n0.500000 0.500000 0.500000 Be\n",
            "nsites": 114,
            "nelements": 2,
            "elements": [
                "Hf",
                "Be"
            ],
            "chemical_system": "Be-Hf",
            "density": 4.823786859274744,
            "density_atomic": 0.10818402748223271,
            "volume": 1053.7599926081737,
            "volume_molar": 5.566571055037703,
            "formula_full": "Hf12 Be102",
            "formula_reduced": "Hf2Be17",
            "formula_anonymous": "A2B17",
            "energy": -526.92119057,
            "energy_per_atom": -4.6221157067543865,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -526.92119057,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0017402,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:49.180000Z",
            "spacegroup": 194
        },
        {
            "id": "mp-30752",
            "created_at": "2022-09-04T14:42:27.827977Z",
            "structure_string": "La4 Mg34\n1.0\n5.179725 -8.971547 0.000000\n5.179725 8.971547 0.000000\n0.000000 0.000000 10.175870\nLa Mg\n4 34\ndirect\n0.666667 0.333333 0.250000 La\n0.333333 0.666667 0.750000 La\n0.000000 0.000000 0.750000 La\n0.000000 0.000000 0.250000 La\n0.162349 0.837651 0.521343 Mg\n0.162349 0.324697 0.521343 Mg\n0.675303 0.837651 0.521343 Mg\n0.324697 0.162349 0.021343 Mg\n0.333333 0.666667 0.100947 Mg\n0.666667 0.333333 0.600947 Mg\n0.666667 0.333333 0.899053 Mg\n0.333333 0.666667 0.399053 Mg\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.000000 0.500000 0.000000 Mg\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.328403 0.964349 0.250000 Mg\n0.364054 0.328403 0.750000 Mg\n0.964349 0.635946 0.750000 Mg\n0.035651 0.364054 0.250000 Mg\n0.635946 0.671597 0.250000 Mg\n0.364054 0.035651 0.750000 Mg\n0.671597 0.635946 0.750000 Mg\n0.671597 0.035651 0.750000 Mg\n0.964349 0.328403 0.750000 Mg\n0.035651 0.671597 0.250000 Mg\n0.635946 0.964349 0.250000 Mg\n0.328403 0.364054 0.250000 Mg\n0.162349 0.324697 0.978657 Mg\n0.837651 0.162349 0.478657 Mg\n0.324697 0.162349 0.478657 Mg\n0.675303 0.837651 0.978657 Mg\n0.162349 0.837651 0.978657 Mg\n0.837651 0.675303 0.021343 Mg\n0.837651 0.162349 0.021343 Mg\n0.837651 0.675303 0.478657 Mg\n",
            "nsites": 38,
            "nelements": 2,
            "elements": [
                "La",
                "Mg"
            ],
            "chemical_system": "La-Mg",
            "density": 2.4264927800225964,
            "density_atomic": 0.04017982225914711,
            "volume": 945.7483349456364,
            "volume_molar": 14.98797262257434,
            "formula_full": "La4 Mg34",
            "formula_reduced": "La2Mg17",
            "formula_anonymous": "A2B17",
            "energy": -76.48385135,
            "energy_per_atom": -2.012732930263158,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -76.48385135,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.8754309,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:47.015000Z",
            "spacegroup": 194
        },
        {
            "id": "mp-1813",
            "created_at": "2022-09-04T14:42:40.723400Z",
            "structure_string": "Ba2 Mg17\n1.0\n6.026205 -5.332691 0.000000\n6.026205 5.332691 0.000000\n1.307215 0.000000 7.940021\nBa Mg\n2 17\ndirect\n0.337880 0.337880 0.337880 Ba\n0.662120 0.662120 0.662120 Ba\n0.297662 0.702338 0.000000 Mg\n0.840036 0.341033 0.341033 Mg\n0.658967 0.159964 0.658967 Mg\n0.100620 0.100620 0.100620 Mg\n0.297662 0.000000 0.702338 Mg\n0.702338 0.297662 0.000000 Mg\n0.341033 0.341033 0.840036 Mg\n0.899380 0.899380 0.899380 Mg\n0.000000 0.702338 0.297662 Mg\n0.000000 0.000000 0.500000 Mg\n0.702338 0.000000 0.297662 Mg\n0.341033 0.840036 0.341033 Mg\n0.159964 0.658967 0.658967 Mg\n0.658967 0.658967 0.159964 Mg\n0.500000 0.000000 0.000000 Mg\n0.000000 0.297662 0.702338 Mg\n0.000000 0.500000 0.000000 Mg\n",
            "nsites": 19,
            "nelements": 2,
            "elements": [
                "Ba",
                "Mg"
            ],
            "chemical_system": "Ba-Mg",
            "density": 2.2381744113358066,
            "density_atomic": 0.037231594275389066,
            "volume": 510.31926968970635,
            "volume_molar": 16.1748130242727,
            "formula_full": "Ba2 Mg17",
            "formula_reduced": "Ba2Mg17",
            "formula_anonymous": "A2B17",
            "energy": -32.11833656,
            "energy_per_atom": -1.6904387663157896,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -32.11833656,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0096232,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:51.072000Z",
            "spacegroup": 166
        },
        {
            "id": "mp-569518",
            "created_at": "2022-09-04T14:42:00.486300Z",
            "structure_string": "U4 Zn34\n1.0\n4.496746 -7.788593 0.000000\n4.496746 7.788593 0.000000\n0.000000 0.000000 8.804587\nU Zn\n4 34\ndirect\n0.000000 0.000000 0.250000 U\n0.000000 0.000000 0.750000 U\n0.666667 0.333333 0.750000 U\n0.333333 0.666667 0.250000 U\n0.366803 0.329329 0.250000 Zn\n0.366803 0.037475 0.250000 Zn\n0.500000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n0.676820 0.838410 0.022504 Zn\n0.161590 0.323180 0.022504 Zn\n0.838410 0.161590 0.977496 Zn\n0.323180 0.161590 0.977496 Zn\n0.633197 0.962525 0.750000 Zn\n0.676820 0.838410 0.477496 Zn\n0.333333 0.666667 0.899822 Zn\n0.329329 0.366803 0.750000 Zn\n0.962525 0.633197 0.250000 Zn\n0.161590 0.323180 0.477496 Zn\n0.329329 0.962525 0.750000 Zn\n0.670671 0.633197 0.250000 Zn\n0.666667 0.333333 0.399822 Zn\n0.323180 0.161590 0.522504 Zn\n0.161590 0.838410 0.022504 Zn\n0.000000 0.500000 0.000000 Zn\n0.037475 0.670671 0.750000 Zn\n0.333333 0.666667 0.600178 Zn\n0.670671 0.037475 0.250000 Zn\n0.666667 0.333333 0.100178 Zn\n0.838410 0.676820 0.977496 Zn\n0.962525 0.329329 0.250000 Zn\n0.838410 0.161590 0.522504 Zn\n0.037475 0.366803 0.750000 Zn\n0.838410 0.676820 0.522504 Zn\n0.500000 0.500000 0.000000 Zn\n0.633197 0.670671 0.750000 Zn\n0.161590 0.838410 0.477496 Zn\n0.500000 0.000000 0.500000 Zn\n0.000000 0.500000 0.500000 Zn\n",
            "nsites": 38,
            "nelements": 2,
            "elements": [
                "U",
                "Zn"
            ],
            "chemical_system": "U-Zn",
            "density": 8.551379857624964,
            "density_atomic": 0.06161511236051984,
            "volume": 616.7318137416669,
            "volume_molar": 9.773804719795843,
            "formula_full": "U4 Zn34",
            "formula_reduced": "U2Zn17",
            "formula_anonymous": "A2B17",
            "energy": -90.36721285,
            "energy_per_atom": -2.3780845486842104,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -90.36721285,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 11.225623,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:32.650000Z",
            "spacegroup": 194
        }
    ]
}