GET /third-parties/MatprojStructure/?format=api&ordering=-energy_per_atom&page=10148
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=-energy_per_atom&page=10149",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-energy_per_atom&page=10147",
    "results": [
        {
            "id": "mp-14416",
            "created_at": "2022-09-04T14:39:32.426210Z",
            "structure_string": "Sm4 Be4 Ge2 O14\n1.0\n7.565533 0.000000 0.000000\n0.000000 7.565533 0.000000\n0.000000 0.000000 4.890554\nSm Be Ge O\n4 4 2 14\ndirect\n0.659034 0.840966 0.504408 Sm\n0.159034 0.659034 0.495592 Sm\n0.840966 0.340966 0.495592 Sm\n0.340966 0.159034 0.504408 Sm\n0.366181 0.866181 0.042969 Be\n0.866181 0.633819 0.957031 Be\n0.633819 0.133819 0.042969 Be\n0.133819 0.366181 0.957031 Be\n0.500000 0.500000 0.000000 Ge\n0.000000 0.000000 0.000000 Ge\n0.920680 0.827067 0.790824 O\n0.172933 0.920680 0.209176 O\n0.579320 0.327067 0.209176 O\n0.420680 0.672933 0.209176 O\n0.327067 0.420680 0.790824 O\n0.672933 0.579320 0.790824 O\n0.000000 0.500000 0.822609 O\n0.500000 0.000000 0.177391 O\n0.141658 0.358342 0.281713 O\n0.641658 0.141658 0.718287 O\n0.358342 0.858342 0.718287 O\n0.858342 0.641658 0.281713 O\n0.079320 0.172933 0.790824 O\n0.827067 0.079320 0.209176 O\n",
            "nsites": 24,
            "nelements": 4,
            "elements": [
                "Sm",
                "Be",
                "Ge",
                "O"
            ],
            "chemical_system": "Be-Ge-O-Sm",
            "density": 5.97225128440099,
            "density_atomic": 0.08573815292693784,
            "volume": 279.9220554757193,
            "volume_molar": 7.023875082930459,
            "formula_full": "Sm4 Be4 Ge2 O14",
            "formula_reduced": "Sm2Be2GeO7",
            "formula_anonymous": "AB2C2D7",
            "energy": -190.57642669,
            "energy_per_atom": -7.940684445416667,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -180.95842669,
            "band_gap": 4.6772,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 9.7e-06,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:43.872000Z",
            "spacegroup": 113
        },
        {
            "id": "mp-1214913",
            "created_at": "2022-09-04T14:47:04.157098Z",
            "structure_string": "Ba8 Yb4 V12 O44\n1.0\n0.000000 -7.866330 0.000000\n-12.129802 0.000000 2.806866\n0.021629 0.000000 -11.260524\nBa Yb V O\n8 4 12 44\ndirect\n0.276890 0.773510 0.942828 Ba\n0.723110 0.226490 0.057172 Ba\n0.776890 0.226490 0.557172 Ba\n0.223110 0.773510 0.442828 Ba\n0.748380 0.553116 0.888731 Ba\n0.251620 0.446884 0.111269 Ba\n0.248380 0.446884 0.611269 Ba\n0.751620 0.553116 0.388731 Ba\n0.500243 0.997289 0.718151 Yb\n0.499757 0.002711 0.281849 Yb\n0.000243 0.002711 0.781849 Yb\n0.999757 0.997289 0.218151 Yb\n0.756903 0.910843 0.977494 V\n0.243097 0.089157 0.022506 V\n0.256903 0.089157 0.522506 V\n0.743097 0.910843 0.477494 V\n0.520347 0.683711 0.673066 V\n0.479653 0.316289 0.326934 V\n0.020347 0.316289 0.826934 V\n0.979653 0.683711 0.173066 V\n0.980861 0.687601 0.670885 V\n0.019139 0.312399 0.329115 V\n0.480861 0.312399 0.829115 V\n0.519139 0.687601 0.170885 V\n0.444130 0.815263 0.717057 O\n0.555870 0.184737 0.282943 O\n0.944130 0.184737 0.782943 O\n0.055870 0.815263 0.217057 O\n0.552088 0.179744 0.807651 O\n0.447912 0.820256 0.192349 O\n0.052088 0.820256 0.692349 O\n0.947912 0.179744 0.307651 O\n0.750771 0.665682 0.667517 O\n0.249229 0.334318 0.332483 O\n0.250771 0.334318 0.832483 O\n0.749229 0.665682 0.167517 O\n0.946112 0.375932 0.968845 O\n0.053888 0.624068 0.031155 O\n0.446112 0.624068 0.531155 O\n0.553888 0.375932 0.468845 O\n0.940987 0.392391 0.730274 O\n0.059013 0.607609 0.269726 O\n0.440987 0.607609 0.769726 O\n0.559013 0.392391 0.230274 O\n0.784273 0.989939 0.623263 O\n0.215727 0.010061 0.376737 O\n0.284273 0.010061 0.876737 O\n0.715727 0.989939 0.123263 O\n0.978073 0.888757 0.975617 O\n0.021927 0.111243 0.024383 O\n0.478073 0.111243 0.524383 O\n0.521927 0.888757 0.475617 O\n0.646658 0.788033 0.947968 O\n0.353342 0.211967 0.052032 O\n0.146658 0.211967 0.552032 O\n0.853342 0.788033 0.447968 O\n0.719255 0.985958 0.867014 O\n0.280745 0.014042 0.132986 O\n0.219255 0.014042 0.632986 O\n0.780745 0.985958 0.367014 O\n0.558052 0.369832 0.716388 O\n0.441948 0.630168 0.283612 O\n0.058052 0.630168 0.783612 O\n0.941948 0.369832 0.216388 O\n0.563457 0.387632 0.962950 O\n0.436543 0.612368 0.037050 O\n0.063457 0.612368 0.537050 O\n0.936543 0.387632 0.462950 O\n",
            "nsites": 68,
            "nelements": 4,
            "elements": [
                "Ba",
                "Yb",
                "V",
                "O"
            ],
            "chemical_system": "Ba-O-V-Yb",
            "density": 4.802482664838574,
            "density_atomic": 0.06331658954059945,
            "volume": 1073.968141578401,
            "volume_molar": 9.5111578240305,
            "formula_full": "Ba8 Yb4 V12 O44",
            "formula_reduced": "Ba2YbV3O11",
            "formula_anonymous": "AB2C3D11",
            "energy": -539.96677784,
            "energy_per_atom": -7.940687909411764,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -489.33877784,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 3.9997098,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:51.955000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-1204545",
            "created_at": "2022-09-04T14:40:56.882338Z",
            "structure_string": "V20 O56\n1.0\n10.544444 0.000000 0.000000\n3.535856 10.080778 0.000000\n0.944949 1.811903 17.248966\nV O\n20 56\ndirect\n0.960430 0.392337 0.447598 V\n0.039570 0.607663 0.552402 V\n0.596148 0.877515 0.065705 V\n0.403852 0.122485 0.934295 V\n0.020449 0.662748 0.360359 V\n0.979551 0.337252 0.639641 V\n0.733823 0.580894 0.564628 V\n0.266177 0.419106 0.435372 V\n0.305220 0.867411 0.010251 V\n0.694780 0.132589 0.989749 V\n0.717522 0.637352 0.375713 V\n0.282478 0.362648 0.624287 V\n0.449792 0.186697 0.112073 V\n0.550208 0.813303 0.887927 V\n0.162846 0.171781 0.057466 V\n0.837154 0.828219 0.942534 V\n0.346392 0.938643 0.183709 V\n0.653608 0.061357 0.816291 V\n0.795533 0.843147 0.475562 V\n0.204467 0.156853 0.524438 V\n0.828133 0.442426 0.384959 O\n0.171867 0.557574 0.615041 O\n0.119250 0.690023 0.290777 O\n0.880750 0.309977 0.709223 O\n0.903890 0.595299 0.471760 O\n0.096110 0.404701 0.528240 O\n0.624284 0.040389 0.085704 O\n0.375716 0.959611 0.914296 O\n0.083983 0.458899 0.382903 O\n0.916017 0.541101 0.617097 O\n0.859231 0.393786 0.543747 O\n0.140769 0.606214 0.456253 O\n0.728940 0.735285 0.907879 O\n0.271060 0.264715 0.092121 O\n0.510282 0.788980 0.005083 O\n0.489718 0.211020 0.994917 O\n0.712631 0.758225 0.555846 O\n0.287369 0.241775 0.444154 O\n0.046614 0.224679 0.451013 O\n0.953386 0.775321 0.548987 O\n0.648942 0.591584 0.474485 O\n0.351058 0.408416 0.525515 O\n0.869594 0.655621 0.316804 O\n0.130406 0.344379 0.683196 O\n0.690086 0.806942 0.404530 O\n0.309914 0.193058 0.595470 O\n0.501653 0.294292 0.147242 O\n0.498347 0.705708 0.852758 O\n0.934163 0.821213 0.398673 O\n0.065837 0.178787 0.601327 O\n0.637491 0.551606 0.634836 O\n0.362509 0.448394 0.365164 O\n0.602152 0.651695 0.315089 O\n0.397848 0.348305 0.684911 O\n0.186451 0.069966 0.153200 O\n0.813549 0.930034 0.846800 O\n0.010615 0.271909 0.057945 O\n0.989385 0.728091 0.942055 O\n0.239722 0.215059 0.952474 O\n0.760278 0.784941 0.047526 O\n0.595913 0.978730 0.953070 O\n0.404087 0.021270 0.046930 O\n0.319565 0.883058 0.271036 O\n0.680435 0.116942 0.728964 O\n0.840583 0.981398 0.987557 O\n0.159417 0.018602 0.012443 O\n0.420860 0.075339 0.193409 O\n0.579140 0.924661 0.806591 O\n0.539223 0.834582 0.156078 O\n0.460777 0.165418 0.843922 O\n0.308651 0.829103 0.115038 O\n0.691349 0.170897 0.884962 O\n0.741534 0.242648 0.026089 O\n0.258466 0.757352 0.973911 O\n0.733843 0.001041 0.482516 O\n0.266157 0.998959 0.517484 O\n",
            "nsites": 76,
            "nelements": 2,
            "elements": [
                "V",
                "O"
            ],
            "chemical_system": "O-V",
            "density": 1.734166922263201,
            "density_atomic": 0.04145078795959003,
            "volume": 1833.4995241608353,
            "volume_molar": 14.528410813012593,
            "formula_full": "V20 O56",
            "formula_reduced": "V5O14",
            "formula_anonymous": "A5B14",
            "energy": -603.49732455,
            "energy_per_atom": -7.940754270394737,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -531.02532455,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 1.9101677,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:21.751000Z",
            "spacegroup": 2
        },
        {
            "id": "mp-1292614",
            "created_at": "2022-09-04T14:44:08.643563Z",
            "structure_string": "Sr4 La2 Mn4 O14\n1.0\n-3.879521 3.983319 0.000131\n-3.879949 -3.983750 -0.000141\n-1.939749 1.992012 10.049844\nSr La Mn O\n4 2 4 14\ndirect\n0.316861 0.000034 0.366353 Sr\n0.816999 0.500034 0.365958 Sr\n0.183037 0.500016 0.634070 Sr\n0.683190 0.999929 0.633624 Sr\n0.499997 0.000175 0.999974 La\n0.999885 0.499912 0.000004 La\n0.097615 0.000037 0.804788 Mn\n0.902202 0.000022 0.195136 Mn\n0.598875 0.499855 0.802335 Mn\n0.401049 0.499926 0.197801 Mn\n0.500151 0.499623 0.000015 O\n0.999866 0.000405 0.999996 O\n0.193444 0.000026 0.613562 O\n0.694218 0.499829 0.611377 O\n0.305492 0.500186 0.388653 O\n0.806840 0.999926 0.386408 O\n0.846322 0.754650 0.816396 O\n0.337248 0.245242 0.816437 O\n0.329005 0.762356 0.817861 O\n0.853397 0.237660 0.817675 O\n0.662788 0.754729 0.183547 O\n0.153689 0.245342 0.183629 O\n0.146811 0.762387 0.182071 O\n0.671017 0.237699 0.182328 O\n",
            "nsites": 24,
            "nelements": 4,
            "elements": [
                "Sr",
                "La",
                "Mn",
                "O"
            ],
            "chemical_system": "La-Mn-O-Sr",
            "density": 5.730609551480071,
            "density_atomic": 0.0772598948023763,
            "volume": 310.63982239931585,
            "volume_molar": 7.794653067292005,
            "formula_full": "Sr4 La2 Mn4 O14",
            "formula_reduced": "Sr2LaMn2O7",
            "formula_anonymous": "AB2C2D7",
            "energy": -190.57935564,
            "energy_per_atom": -7.9408064849999995,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -174.28935564,
            "band_gap": 0.5074999999999994,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 14.0000879,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:26.619000Z",
            "spacegroup": 65
        },
        {
            "id": "mp-1247713",
            "created_at": "2022-09-04T14:44:58.527742Z",
            "structure_string": "Ca8 Ti3 Mn5 O24\n1.0\n7.682377 0.000000 0.000000\n0.000000 7.669908 0.000000\n0.000000 0.000000 7.682377\nCa Ti Mn O\n8 3 5 24\ndirect\n0.252269 0.257312 0.252269 Ca\n0.252269 0.257312 0.747731 Ca\n0.252269 0.742688 0.252269 Ca\n0.252269 0.742688 0.747731 Ca\n0.747731 0.257312 0.252269 Ca\n0.747731 0.257312 0.747731 Ca\n0.747731 0.742688 0.252269 Ca\n0.747731 0.742688 0.747731 Ca\n0.000000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.500000 0.000000 0.000000 Ti\n0.000000 0.500000 0.000000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.250537 O\n0.000000 0.000000 0.749463 O\n0.000000 0.500000 0.250141 O\n0.000000 0.500000 0.749859 O\n0.500000 0.000000 0.252822 O\n0.500000 0.000000 0.747178 O\n0.500000 0.500000 0.250152 O\n0.500000 0.500000 0.749848 O\n0.250537 0.000000 0.000000 O\n0.252822 0.000000 0.500000 O\n0.250141 0.500000 0.000000 O\n0.250152 0.500000 0.500000 O\n0.749463 0.000000 0.000000 O\n0.747178 0.000000 0.500000 O\n0.749859 0.500000 0.000000 O\n0.749848 0.500000 0.500000 O\n0.000000 0.253781 0.000000 O\n0.000000 0.253469 0.500000 O\n0.000000 0.746219 0.000000 O\n0.000000 0.746531 0.500000 O\n0.500000 0.253469 0.000000 O\n0.500000 0.250643 0.500000 O\n0.500000 0.746531 0.000000 O\n0.500000 0.749357 0.500000 O\n",
            "nsites": 40,
            "nelements": 4,
            "elements": [
                "Ca",
                "Ti",
                "Mn",
                "O"
            ],
            "chemical_system": "Ca-Mn-O-Ti",
            "density": 4.11916427687316,
            "density_atomic": 0.08836465890909384,
            "volume": 452.66965881858334,
            "volume_molar": 6.81510100796671,
            "formula_full": "Ca8 Ti3 Mn5 O24",
            "formula_reduced": "Ca8Ti3Mn5O24",
            "formula_anonymous": "A3B5C8D24",
            "energy": -317.63238719,
            "energy_per_atom": -7.940809679749999,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -292.80438719,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 15.1662879,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:49.266000Z",
            "spacegroup": 123
        },
        {
            "id": "mp-1214494",
            "created_at": "2022-09-04T14:44:27.583843Z",
            "structure_string": "Ba10 Y4 Zr2 Al4 O26\n1.0\n3.024128 -5.237943 0.000000\n3.024128 5.237943 0.000000\n0.000000 0.000000 25.333824\nBa Y Zr Al O\n10 4 2 4 26\ndirect\n0.333333 0.666667 0.541400 Ba\n0.666667 0.333333 0.458600 Ba\n0.666667 0.333333 0.041400 Ba\n0.333333 0.666667 0.958600 Ba\n0.000000 0.000000 0.136760 Ba\n0.000000 0.000000 0.863240 Ba\n0.000000 0.000000 0.636760 Ba\n0.000000 0.000000 0.363240 Ba\n0.333333 0.666667 0.250000 Ba\n0.666667 0.333333 0.750000 Ba\n0.333333 0.666667 0.104206 Y\n0.666667 0.333333 0.895794 Y\n0.666667 0.333333 0.604206 Y\n0.333333 0.666667 0.395794 Y\n0.000000 0.000000 0.000000 Zr\n0.000000 0.000000 0.500000 Zr\n0.333333 0.666667 0.681309 Al\n0.666667 0.333333 0.318691 Al\n0.666667 0.333333 0.181309 Al\n0.333333 0.666667 0.818691 Al\n0.505755 0.011511 0.158697 O\n0.494245 0.988489 0.841303 O\n0.988489 0.494245 0.158697 O\n0.494245 0.988489 0.658697 O\n0.011511 0.505755 0.841303 O\n0.505755 0.011511 0.341303 O\n0.505755 0.494245 0.158697 O\n0.011511 0.505755 0.658697 O\n0.494245 0.505755 0.841303 O\n0.988489 0.494245 0.341303 O\n0.494245 0.505755 0.658697 O\n0.505755 0.494245 0.341303 O\n0.162216 0.324432 0.050071 O\n0.837784 0.675568 0.949929 O\n0.675568 0.837784 0.050071 O\n0.837784 0.675568 0.550071 O\n0.324432 0.162216 0.949929 O\n0.162216 0.324432 0.449929 O\n0.162216 0.837784 0.050071 O\n0.324432 0.162216 0.550071 O\n0.837784 0.162216 0.949929 O\n0.675568 0.837784 0.449929 O\n0.837784 0.162216 0.550071 O\n0.162216 0.837784 0.449929 O\n0.333333 0.666667 0.750000 O\n0.666667 0.333333 0.250000 O\n",
            "nsites": 46,
            "nelements": 5,
            "elements": [
                "Ba",
                "Y",
                "Zr",
                "Al",
                "O"
            ],
            "chemical_system": "Al-Ba-O-Y-Zr",
            "density": 5.038500615404804,
            "density_atomic": 0.05731471663640211,
            "volume": 802.5861890205031,
            "volume_molar": 10.507145657203122,
            "formula_full": "Ba10 Y4 Zr2 Al4 O26",
            "formula_reduced": "Ba5Y2ZrAl2O13",
            "formula_anonymous": "AB2C2D5E13",
            "energy": -365.27807919,
            "energy_per_atom": -7.940827808478262,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -347.41607919,
            "band_gap": 2.6225000000000005,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 4.68e-05,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:37.764000Z",
            "spacegroup": 194
        },
        {
            "id": "mp-776606",
            "created_at": "2022-09-04T14:47:12.684945Z",
            "structure_string": "Fe16 O24\n1.0\n5.142575 0.000000 0.000000\n0.015577 5.383236 0.000000\n0.003672 0.101670 14.901235\nFe O\n16 24\ndirect\n0.999625 0.822817 0.076310 Fe\n0.002114 0.260492 0.179052 Fe\n0.996659 0.683622 0.572028 Fe\n0.002900 0.237011 0.679902 Fe\n0.499730 0.760369 0.181764 Fe\n0.497514 0.741008 0.680792 Fe\n0.501336 0.323408 0.074901 Fe\n0.502296 0.185348 0.572552 Fe\n0.496810 0.814329 0.426400 Fe\n0.497285 0.684363 0.929838 Fe\n0.499879 0.255738 0.319010 Fe\n0.501423 0.244342 0.821260 Fe\n0.000938 0.312635 0.425233 Fe\n0.001932 0.750985 0.324339 Fe\n0.996202 0.738764 0.821114 Fe\n0.001505 0.181076 0.928531 Fe\n0.863222 0.881886 0.205698 O\n0.857853 0.610094 0.702804 O\n0.853097 0.154772 0.052028 O\n0.846527 0.334210 0.548835 O\n0.808202 0.035496 0.372689 O\n0.802274 0.458431 0.877338 O\n0.702134 0.544658 0.371523 O\n0.702241 0.959369 0.876649 O\n0.653488 0.833039 0.549328 O\n0.652364 0.655581 0.051890 O\n0.635406 0.383815 0.200956 O\n0.639751 0.110431 0.702714 O\n0.346209 0.896895 0.297312 O\n0.357525 0.610229 0.797190 O\n0.352774 0.170566 0.447911 O\n0.348067 0.330961 0.950505 O\n0.298283 0.461706 0.621850 O\n0.305908 0.045708 0.123718 O\n0.194332 0.546429 0.121955 O\n0.196042 0.958138 0.622362 O\n0.146715 0.670150 0.446898 O\n0.153387 0.832723 0.951576 O\n0.142991 0.111979 0.797017 O\n0.143062 0.406426 0.296230 O\n",
            "nsites": 40,
            "nelements": 2,
            "elements": [
                "Fe",
                "O"
            ],
            "chemical_system": "Fe-O",
            "density": 5.142396889299271,
            "density_atomic": 0.09696470347166637,
            "volume": 412.5212429663978,
            "volume_molar": 6.210652479084518,
            "formula_full": "Fe16 O24",
            "formula_reduced": "Fe2O3",
            "formula_anonymous": "A2B3",
            "energy": -317.63419545,
            "energy_per_atom": -7.9408548862499995,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -265.05019545,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 80.0004501,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:38:00.326000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-772992",
            "created_at": "2022-09-04T14:41:02.472498Z",
            "structure_string": "Li9 Fe3 W7 O28\n1.0\n6.051835 -6.037968 0.000000\n6.051835 6.037968 0.000000\n0.027702 0.000000 8.548743\nLi Fe W O\n9 3 7 28\ndirect\n0.902372 0.360369 0.643440 Li\n0.902372 0.643440 0.360369 Li\n0.643440 0.360369 0.902372 Li\n0.643440 0.902372 0.360369 Li\n0.353968 0.095676 0.353968 Li\n0.353968 0.353968 0.095676 Li\n0.360369 0.643440 0.902372 Li\n0.360369 0.902372 0.643440 Li\n0.095676 0.353968 0.353968 Li\n0.637394 0.099806 0.637394 Fe\n0.637394 0.637394 0.099806 Fe\n0.099806 0.637394 0.637394 Fe\n0.000521 0.000521 0.499006 W\n0.000521 0.499006 0.000521 W\n0.642315 0.358728 0.358728 W\n0.645402 0.645402 0.645402 W\n0.499006 0.000521 0.000521 W\n0.358728 0.358728 0.642315 W\n0.358728 0.642315 0.358728 W\n0.851811 0.382364 0.382364 O\n0.861942 0.613664 0.613664 O\n0.877187 0.125608 0.622211 O\n0.877187 0.622211 0.125608 O\n0.878765 0.378008 0.878765 O\n0.878765 0.878765 0.378008 O\n0.622211 0.125608 0.877187 O\n0.622211 0.877187 0.125608 O\n0.608837 0.384783 0.608837 O\n0.608837 0.608837 0.384783 O\n0.615252 0.145800 0.385724 O\n0.615252 0.385724 0.145800 O\n0.613664 0.613664 0.861942 O\n0.613664 0.861942 0.613664 O\n0.385724 0.145800 0.615252 O\n0.385724 0.615252 0.145800 O\n0.382364 0.382364 0.851811 O\n0.382364 0.851811 0.382364 O\n0.391942 0.391942 0.391942 O\n0.384783 0.608837 0.608837 O\n0.378930 0.122987 0.122987 O\n0.378008 0.878765 0.878765 O\n0.122987 0.122987 0.378930 O\n0.122987 0.378930 0.122987 O\n0.125608 0.622211 0.877187 O\n0.125608 0.877187 0.622211 O\n0.145800 0.385724 0.615252 O\n0.145800 0.615252 0.385724 O\n",
            "nsites": 47,
            "nelements": 4,
            "elements": [
                "Li",
                "Fe",
                "W",
                "O"
            ],
            "chemical_system": "Fe-Li-O-W",
            "density": 5.222424352335357,
            "density_atomic": 0.07522942032657176,
            "volume": 624.7555782827047,
            "volume_molar": 8.005034112794993,
            "formula_full": "Li9 Fe3 W7 O28",
            "formula_reduced": "Li9Fe3(WO4)7",
            "formula_anonymous": "A3B7C9D28",
            "energy": -373.22077932,
            "energy_per_atom": -7.940867645106383,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -316.15077932,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 12.9963673,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:23.547000Z",
            "spacegroup": 160
        },
        {
            "id": "mp-9842",
            "created_at": "2022-09-04T14:47:24.847688Z",
            "structure_string": "Rb2 Sm2 C4 O12\n1.0\n4.841326 4.448004 0.000000\n-4.841326 4.448004 0.000000\n0.000000 2.676923 6.817979\nRb Sm C O\n2 2 4 12\ndirect\n0.885830 0.114170 0.250000 Rb\n0.114170 0.885830 0.750000 Rb\n0.404111 0.595889 0.250000 Sm\n0.595889 0.404111 0.750000 Sm\n0.603842 0.851160 0.751958 C\n0.148840 0.396158 0.748042 C\n0.396158 0.148840 0.248042 C\n0.851160 0.603842 0.251958 C\n0.048643 0.601372 0.237476 O\n0.398628 0.951357 0.262524 O\n0.951357 0.398628 0.762524 O\n0.601372 0.048643 0.737476 O\n0.784496 0.734620 0.123685 O\n0.265380 0.215504 0.376315 O\n0.215504 0.265380 0.876315 O\n0.734620 0.784496 0.623685 O\n0.702608 0.468698 0.397020 O\n0.531302 0.297392 0.102980 O\n0.297392 0.531302 0.602980 O\n0.468698 0.702608 0.897020 O\n",
            "nsites": 20,
            "nelements": 4,
            "elements": [
                "Rb",
                "Sm",
                "C",
                "O"
            ],
            "chemical_system": "C-O-Rb-Sm",
            "density": 4.02462612143004,
            "density_atomic": 0.06811062162353643,
            "volume": 293.63995692984196,
            "volume_molar": 8.84170576695923,
            "formula_full": "Rb2 Sm2 C4 O12",
            "formula_reduced": "RbSm(CO3)2",
            "formula_anonymous": "ABC2D6",
            "energy": -158.81753949,
            "energy_per_atom": -7.9408769745,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -150.57353949,
            "band_gap": 4.1976,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0003551,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:38:07.049000Z",
            "spacegroup": 15
        },
        {
            "id": "mp-1222629",
            "created_at": "2022-09-04T14:41:35.331386Z",
            "structure_string": "Li4 Sc1 Fe3 Si8 O24\n1.0\n8.854309 0.000000 0.000000\n0.000000 5.374537 0.000000\n0.000000 1.937664 9.234908\nLi Sc Fe Si O\n4 1 3 8 24\ndirect\n0.758805 0.500000 0.500000 Li\n0.257145 0.000000 0.000000 Li\n0.241478 0.000000 0.500000 Li\n0.743041 0.500000 0.000000 Li\n0.397970 0.500000 0.500000 Sc\n0.897028 0.000000 0.000000 Fe\n0.605327 0.000000 0.500000 Fe\n0.103057 0.500000 0.000000 Fe\n0.086281 0.722014 0.294159 Si\n0.590108 0.218515 0.797394 Si\n0.086281 0.277986 0.705841 Si\n0.590108 0.781485 0.202606 Si\n0.910587 0.779317 0.704372 Si\n0.411387 0.278248 0.202450 Si\n0.910587 0.220683 0.295628 Si\n0.411387 0.721752 0.797550 Si\n0.252279 0.715005 0.365643 O\n0.755756 0.210430 0.870142 O\n0.252279 0.284995 0.634357 O\n0.755756 0.789570 0.129858 O\n0.744821 0.788254 0.630849 O\n0.244947 0.290155 0.130285 O\n0.744821 0.211746 0.369151 O\n0.244947 0.709845 0.869715 O\n0.999035 0.450312 0.353753 O\n0.499882 0.949894 0.856490 O\n0.999035 0.549688 0.646247 O\n0.499882 0.050106 0.143510 O\n0.998760 0.049839 0.645934 O\n0.500647 0.549920 0.146650 O\n0.998760 0.950161 0.354066 O\n0.500647 0.450080 0.853350 O\n0.082970 0.782900 0.114988 O\n0.588746 0.277963 0.618206 O\n0.082970 0.217100 0.885012 O\n0.588746 0.722037 0.381794 O\n0.915532 0.717471 0.883630 O\n0.416337 0.208574 0.381341 O\n0.915532 0.282529 0.116370 O\n0.416337 0.791426 0.618659 O\n",
            "nsites": 40,
            "nelements": 5,
            "elements": [
                "Li",
                "Sc",
                "Fe",
                "Si",
                "O"
            ],
            "chemical_system": "Fe-Li-O-Sc-Si",
            "density": 3.207671361900295,
            "density_atomic": 0.09101892187964077,
            "volume": 439.46905955328896,
            "volume_molar": 6.616361340736822,
            "formula_full": "Li4 Sc1 Fe3 Si8 O24",
            "formula_reduced": "Li4ScFe3(SiO3)8",
            "formula_anonymous": "AB3C4D8E24",
            "energy": -317.63882444,
            "energy_per_atom": -7.940970611,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -294.38282444,
            "band_gap": 2.8003,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 14.9674807,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:25.519000Z",
            "spacegroup": 3
        },
        {
            "id": "mp-1208032",
            "created_at": "2022-09-04T14:47:02.278379Z",
            "structure_string": "Y4 V8 O8\n1.0\n-4.556758 4.556758 4.385802\n4.556758 -4.556758 4.385802\n4.556758 4.556758 -4.385802\nY V O\n4 8 8\ndirect\n0.125000 0.875000 0.750000 Y\n0.125000 0.375000 0.250000 Y\n0.625000 0.875000 0.750000 Y\n0.125000 0.875000 0.250000 Y\n0.498052 0.829497 0.331445 V\n0.498052 0.166607 0.668555 V\n0.416607 0.248052 0.168555 V\n0.751948 0.583393 0.831445 V\n0.751948 0.920503 0.168555 V\n0.079497 0.248052 0.831445 V\n0.833393 0.501948 0.331445 V\n0.170503 0.501948 0.668555 V\n0.350766 0.504232 0.153467 O\n0.350766 0.197299 0.846533 O\n0.447299 0.100766 0.346533 O\n0.899234 0.552701 0.653467 O\n0.899234 0.245768 0.346533 O\n0.754232 0.100766 0.653467 O\n0.802701 0.649234 0.153467 O\n0.495768 0.649234 0.846533 O\n",
            "nsites": 20,
            "nelements": 3,
            "elements": [
                "Y",
                "V",
                "O"
            ],
            "chemical_system": "O-V-Y",
            "density": 4.062367969652418,
            "density_atomic": 0.054904640676035135,
            "volume": 364.26793352514613,
            "volume_molar": 10.968363850213766,
            "formula_full": "Y4 V8 O8",
            "formula_reduced": "YV2O2",
            "formula_anonymous": "AB2C2",
            "energy": -158.81998293,
            "energy_per_atom": -7.9409991465,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -139.72398293,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 24.1623024,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:53.488000Z",
            "spacegroup": 141
        },
        {
            "id": "mp-30165",
            "created_at": "2022-09-04T14:44:24.475058Z",
            "structure_string": "Sr7 Re4 O19\n1.0\n2.819277 6.923655 0.000000\n-2.819277 6.923655 0.000000\n0.000000 1.580659 10.394622\nSr Re O\n7 4 19\ndirect\n0.210776 0.210776 0.412777 Sr\n0.789224 0.789224 0.587223 Sr\n0.416224 0.416224 0.164636 Sr\n0.583776 0.583776 0.835364 Sr\n0.500000 0.500000 0.500000 Sr\n0.858467 0.858467 0.957544 Sr\n0.141533 0.141533 0.042456 Sr\n0.966858 0.966858 0.322818 Re\n0.033142 0.033142 0.677182 Re\n0.669238 0.669238 0.219795 Re\n0.330762 0.330762 0.780205 Re\n0.000000 0.000000 0.500000 O\n0.696112 0.696112 0.386621 O\n0.303888 0.303888 0.613379 O\n0.044659 0.044659 0.854273 O\n0.955341 0.955341 0.145727 O\n0.398212 0.398212 0.930397 O\n0.601788 0.601788 0.069603 O\n0.825278 0.316448 0.284652 O\n0.683552 0.174722 0.715348 O\n0.174722 0.683552 0.715348 O\n0.316448 0.825278 0.284652 O\n0.630412 0.121372 0.373213 O\n0.878628 0.369588 0.626787 O\n0.369588 0.878628 0.626787 O\n0.121372 0.630412 0.373213 O\n0.995880 0.516756 0.153687 O\n0.483244 0.004120 0.846313 O\n0.004120 0.483244 0.846313 O\n0.516756 0.995880 0.153687 O\n",
            "nsites": 30,
            "nelements": 3,
            "elements": [
                "Sr",
                "Re",
                "O"
            ],
            "chemical_system": "O-Re-Sr",
            "density": 6.80156999612751,
            "density_atomic": 0.07392807378046223,
            "volume": 405.79983307949277,
            "volume_molar": 8.145945717297367,
            "formula_full": "Sr7 Re4 O19",
            "formula_reduced": "Sr7Re4O19",
            "formula_anonymous": "A4B7C19",
            "energy": -238.23012585,
            "energy_per_atom": -7.9410041950000005,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -225.17712585,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 2.3862452,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:20.931000Z",
            "spacegroup": 12
        }
    ]
}