GET /third-parties/MatprojStructure/?format=api&ordering=-total_magnetization&page=1732
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=-total_magnetization&page=1733",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-total_magnetization&page=1731",
    "results": [
        {
            "id": "mp-1662129",
            "created_at": "2022-09-04T14:48:01.137701Z",
            "structure_string": "Li4 Co4 P4 O16\n1.0\n5.462806 0.491627 0.000086\n1.996973 10.635426 0.000119\n0.000071 0.000036 6.127913\nLi Co P O\n4 4 4 16\ndirect\n0.273236 0.300695 0.525958 Li\n0.226756 0.199287 0.025945 Li\n0.773234 0.800701 0.974051 Li\n0.726800 0.699305 0.474029 Li\n0.129787 0.899339 0.668102 Co\n0.370224 0.600665 0.168067 Co\n0.629807 0.399333 0.831912 Co\n0.870206 0.100659 0.331911 Co\n0.231265 0.640358 0.656738 P\n0.268713 0.859650 0.156763 P\n0.731255 0.140351 0.843252 P\n0.768754 0.359638 0.343252 P\n0.966219 0.741159 0.690504 O\n0.078114 0.777408 0.143280 O\n0.223988 0.559235 0.450724 O\n0.301195 0.546613 0.857455 O\n0.198818 0.953382 0.357500 O\n0.275937 0.940812 0.950729 O\n0.466173 0.241165 0.809514 O\n0.578148 0.277409 0.356722 O\n0.421864 0.722589 0.643268 O\n0.533797 0.758835 0.190464 O\n0.724002 0.059201 0.049293 O\n0.801191 0.046614 0.642520 O\n0.698844 0.453389 0.142517 O\n0.776003 0.440783 0.549271 O\n0.921853 0.222600 0.856742 O\n0.033818 0.258824 0.309517 O\n",
            "nsites": 28,
            "nelements": 4,
            "elements": [
                "Li",
                "Co",
                "P",
                "O"
            ],
            "chemical_system": "Co-Li-O-P",
            "density": 3.0523642119413132,
            "density_atomic": 0.07999746526423845,
            "volume": 350.01108982032883,
            "volume_molar": 7.527914465925083,
            "formula_full": "Li4 Co4 P4 O16",
            "formula_reduced": "LiCoPO4",
            "formula_anonymous": "ABCD4",
            "energy": -202.11038515,
            "energy_per_atom": -7.218228041071429,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -184.56638515,
            "band_gap": 2.9034,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 12.0001028,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:38:31.557000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-1175781",
            "created_at": "2022-09-04T14:46:20.130892Z",
            "structure_string": "Li9 Mn2 Co5 O16\n1.0\n4.981932 0.000000 0.000000\n-0.164221 5.942898 0.000000\n-0.588784 -1.768374 9.635965\nLi Mn Co O\n9 2 5 16\ndirect\n0.881279 0.817415 0.254448 Li\n0.127357 0.687091 0.748296 Li\n0.372474 0.570358 0.254615 Li\n0.878564 0.309643 0.253527 Li\n0.121631 0.182013 0.746478 Li\n0.382750 0.056175 0.253461 Li\n0.611560 0.931522 0.744120 Li\n0.628822 0.440558 0.746477 Li\n0.250405 0.874959 0.499165 Li\n0.000767 0.999979 0.998804 Mn\n0.247954 0.372261 0.502077 Mn\n0.500608 0.747868 0.999971 Co\n0.749891 0.630600 0.499707 Co\n0.999602 0.500718 0.001218 Co\n0.500570 0.253731 0.000080 Co\n0.743312 0.118120 0.498139 Co\n0.694103 0.032578 0.113204 O\n0.897925 0.907952 0.604731 O\n0.196470 0.756002 0.118227 O\n0.698449 0.535118 0.115139 O\n0.950067 0.378975 0.615475 O\n0.200057 0.262946 0.117561 O\n0.449310 0.171575 0.608774 O\n0.439293 0.638970 0.611256 O\n0.058939 0.574813 0.394076 O\n0.300939 0.469158 0.887752 O\n0.569096 0.346427 0.394676 O\n0.055574 0.110495 0.390273 O\n0.304523 0.966690 0.881061 O\n0.580754 0.873984 0.381027 O\n0.804181 0.735635 0.881687 O\n0.802777 0.245670 0.884498 O\n",
            "nsites": 32,
            "nelements": 4,
            "elements": [
                "Li",
                "Mn",
                "Co",
                "O"
            ],
            "chemical_system": "Co-Li-Mn-O",
            "density": 4.2082059792217015,
            "density_atomic": 0.11216534400888724,
            "volume": 285.2931115466871,
            "volume_molar": 5.368985236226661,
            "formula_full": "Li9 Mn2 Co5 O16",
            "formula_reduced": "Li9Mn2Co5O16",
            "formula_anonymous": "A2B5C9D16",
            "energy": -208.75950061,
            "energy_per_atom": -6.5237343940625,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -186.24150061,
            "band_gap": 0.3458000000000001,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 12.0001027,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:23.819000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-1201530",
            "created_at": "2022-09-04T14:40:41.855314Z",
            "structure_string": "Ba1 Na6 Th1 C6 O24\n1.0\n4.943761 -6.943449 0.000000\n4.943761 6.943449 0.000000\n-4.808223 0.000000 7.037986\nBa Na Th C O\n1 6 1 6 24\ndirect\n0.500000 0.500000 0.500000 Ba\n0.950132 0.196298 0.463332 Na\n0.196298 0.463332 0.950132 Na\n0.463332 0.950132 0.196298 Na\n0.049868 0.803702 0.536668 Na\n0.803702 0.536668 0.049868 Na\n0.536668 0.049868 0.803702 Na\n0.000000 0.000000 0.000000 Th\n0.015399 0.373355 0.215283 C\n0.373355 0.215283 0.015399 C\n0.215283 0.015399 0.373355 C\n0.984601 0.626645 0.784717 C\n0.626645 0.784717 0.984601 C\n0.784717 0.984601 0.626645 C\n0.298127 0.031695 0.936828 O\n0.031695 0.936828 0.298127 O\n0.936828 0.298127 0.031695 O\n0.701873 0.968305 0.063172 O\n0.968305 0.063172 0.701873 O\n0.063172 0.701873 0.968305 O\n0.289448 0.293360 0.090069 O\n0.293360 0.090069 0.289448 O\n0.090069 0.289448 0.293360 O\n0.710552 0.706640 0.909931 O\n0.706640 0.909931 0.710552 O\n0.909931 0.710552 0.706640 O\n0.982735 0.473770 0.685696 O\n0.473770 0.685696 0.982735 O\n0.685696 0.982735 0.473770 O\n0.017265 0.526230 0.314304 O\n0.526230 0.314304 0.017265 O\n0.314304 0.017265 0.526230 O\n0.273996 0.671375 0.602744 O\n0.671375 0.602744 0.273996 O\n0.602744 0.273996 0.671375 O\n0.726004 0.328625 0.397256 O\n0.328625 0.397256 0.726004 O\n0.397256 0.726004 0.328625 O\n",
            "nsites": 38,
            "nelements": 5,
            "elements": [
                "Ba",
                "Na",
                "Th",
                "C",
                "O"
            ],
            "chemical_system": "Ba-C-Na-O-Th",
            "density": 3.3107291655913684,
            "density_atomic": 0.07864524781595036,
            "volume": 483.182405234828,
            "volume_molar": 7.65734857126183,
            "formula_full": "Ba1 Na6 Th1 C6 O24",
            "formula_reduced": "BaNa6Th(CO4)6",
            "formula_anonymous": "ABC6D6E24",
            "energy": -256.62998199000003,
            "energy_per_atom": -6.753420578684211,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -240.14198199,
            "band_gap": 0.2049,
            "is_gap_direct": true,
            "is_magnetic": true,
            "total_magnetization": 12.0001009,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:06.332000Z",
            "spacegroup": 148
        },
        {
            "id": "mp-685430",
            "created_at": "2022-09-04T14:45:19.572196Z",
            "structure_string": "Nd4 Mo31 O56\n1.0\n10.705340 0.034802 10.687657\n4.755421 7.568106 4.737890\n-1.212488 0.009070 11.902945\nNd Mo O\n4 31 56\ndirect\n0.260651 0.990672 0.491988 Nd\n0.504622 0.499924 0.003548 Nd\n0.750324 0.999314 0.499524 Nd\n0.986442 0.503784 0.005672 Nd\n0.016842 0.006108 0.124412 Mo\n0.004515 0.140815 0.379592 Mo\n0.278104 0.236075 0.121017 Mo\n0.132306 0.643721 0.120962 Mo\n0.027044 0.191281 0.876800 Mo\n0.521504 0.004049 0.119857 Mo\n0.027801 0.588632 0.621990 Mo\n0.271743 0.377742 0.381033 Mo\n0.149532 0.732867 0.380349 Mo\n0.267103 0.336903 0.625524 Mo\n0.507256 0.139759 0.377864 Mo\n0.149960 0.698562 0.621272 Mo\n0.400994 0.500580 0.369956 Mo\n0.403105 0.882066 0.119851 Mo\n0.399240 0.088367 0.879383 Mo\n0.381247 0.470168 0.622573 Mo\n0.776423 0.249740 0.118521 Mo\n0.142210 0.834503 0.875524 Mo\n0.519931 0.200682 0.879444 Mo\n0.529660 0.587797 0.619841 Mo\n0.256398 0.969769 0.877341 Mo\n0.773029 0.378050 0.381204 Mo\n0.652245 0.729443 0.375127 Mo\n0.768047 0.333883 0.627110 Mo\n0.650912 0.700758 0.619377 Mo\n0.892721 0.505895 0.375897 Mo\n0.898212 0.884777 0.120654 Mo\n0.897948 0.089668 0.879821 Mo\n0.882760 0.471978 0.622279 Mo\n0.642315 0.839053 0.879026 Mo\n0.748686 0.971376 0.881836 Mo\n0.067393 0.189924 0.012402 O\n0.211196 0.289445 0.999601 O\n0.204290 0.085283 0.252597 O\n0.082011 0.472434 0.239016 O\n0.323269 0.414798 0.011264 O\n0.074814 0.427851 0.511037 O\n0.320494 0.197188 0.271396 O\n0.225763 0.775504 0.000056 O\n0.217421 0.989278 0.731287 O\n0.212307 0.584056 0.243512 O\n0.073168 0.388104 0.768413 O\n0.070886 0.971746 0.261584 O\n0.316395 0.163834 0.514298 O\n0.563983 0.195855 0.012736 O\n0.461340 0.342655 0.234978 O\n0.086907 0.911809 0.489304 O\n0.321035 0.125642 0.760821 O\n0.342640 0.695880 0.230880 O\n0.192753 0.498637 0.767319 O\n0.711181 0.290272 0.999806 O\n0.475844 0.269652 0.504364 O\n0.090203 0.888660 0.732632 O\n0.075486 0.667028 0.987720 O\n0.705498 0.082904 0.259164 O\n0.330018 0.689480 0.487416 O\n0.581234 0.444171 0.250205 O\n0.461085 0.249703 0.742192 O\n0.445042 0.850483 0.254156 O\n0.332360 0.624756 0.739212 O\n0.836872 0.399760 0.008738 O\n0.574901 0.427349 0.511947 O\n0.823160 0.196832 0.270342 O\n0.463898 0.786382 0.497722 O\n0.712152 0.778104 0.007809 O\n0.707909 0.000541 0.733287 O\n0.727573 0.579267 0.240161 O\n0.571965 0.390472 0.768525 O\n0.571832 0.970223 0.261391 O\n0.816542 0.160890 0.515333 O\n0.455519 0.748700 0.756923 O\n0.962525 0.344741 0.236237 O\n0.588055 0.911899 0.488027 O\n0.332192 0.931691 0.992265 O\n0.822138 0.132209 0.759339 O\n0.843069 0.699570 0.232635 O\n0.694919 0.500897 0.765809 O\n0.977243 0.274524 0.498776 O\n0.589763 0.888876 0.731851 O\n0.570363 0.680909 0.994090 O\n0.829801 0.691973 0.486936 O\n0.962136 0.249233 0.743375 O\n0.946386 0.847394 0.264279 O\n0.831800 0.625375 0.740247 O\n0.961260 0.788048 0.501034 O\n0.953121 0.746726 0.760486 O\n0.833464 0.930153 0.990614 O\n",
            "nsites": 91,
            "nelements": 3,
            "elements": [
                "Nd",
                "Mo",
                "O"
            ],
            "chemical_system": "Mo-Nd-O",
            "density": 6.9647735796988535,
            "density_atomic": 0.08582719159005485,
            "volume": 1060.2700416279793,
            "volume_molar": 7.016588389334891,
            "formula_full": "Nd4 Mo31 O56",
            "formula_reduced": "Nd4Mo31O56",
            "formula_anonymous": "A4B31C56",
            "energy": -792.2317089999999,
            "energy_per_atom": -8.705842956043956,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -654.497709,
            "band_gap": 0.3997999999999999,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 12.0000998,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:00.472000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-860887",
            "created_at": "2022-09-04T14:47:13.492239Z",
            "structure_string": "Li9 Mn3 P6 O24\n1.0\n7.256280 0.000000 0.000000\n-0.277791 8.388114 0.000000\n-0.817818 -4.175811 7.446807\nLi Mn P O\n9 3 6 24\ndirect\n0.297451 0.695007 0.033172 Li\n0.319510 0.354637 0.320168 Li\n0.500000 0.000000 0.000000 Li\n0.518368 0.324318 0.675934 Li\n0.644878 0.035916 0.338772 Li\n0.355122 0.964084 0.661228 Li\n0.481632 0.675682 0.324066 Li\n0.680490 0.645363 0.679832 Li\n0.702549 0.304993 0.966828 Li\n0.000000 0.000000 0.000000 Mn\n0.953271 0.332563 0.654669 Mn\n0.046729 0.667437 0.345331 Mn\n0.263095 0.640777 0.683562 P\n0.219720 0.030885 0.349021 P\n0.249177 0.307711 0.960863 P\n0.750823 0.692289 0.039137 P\n0.780280 0.969115 0.650979 P\n0.736905 0.359223 0.316438 P\n0.808532 0.799093 0.937999 O\n0.440522 0.552029 0.696538 O\n0.103316 0.566285 0.747777 O\n0.725956 0.489085 0.896115 O\n0.780656 0.409220 0.519300 O\n0.712128 0.150778 0.193939 O\n0.090136 0.267564 0.810996 O\n0.060163 0.147282 0.422300 O\n0.182470 0.930763 0.136914 O\n0.406725 0.149081 0.411291 O\n0.425360 0.229624 0.870453 O\n0.755874 0.125161 0.599391 O\n0.244126 0.874839 0.400609 O\n0.574640 0.770376 0.129547 O\n0.593275 0.850919 0.588709 O\n0.817530 0.069237 0.863086 O\n0.939837 0.852718 0.577700 O\n0.909864 0.732436 0.189004 O\n0.287872 0.849222 0.806061 O\n0.219344 0.590780 0.480700 O\n0.274044 0.510915 0.103885 O\n0.896684 0.433715 0.252223 O\n0.559478 0.447971 0.303462 O\n0.191468 0.200907 0.062001 O\n",
            "nsites": 42,
            "nelements": 4,
            "elements": [
                "Li",
                "Mn",
                "P",
                "O"
            ],
            "chemical_system": "Li-Mn-O-P",
            "density": 2.9202471717060385,
            "density_atomic": 0.09266182196804393,
            "volume": 453.26110697979203,
            "volume_molar": 6.499052826823158,
            "formula_full": "Li9 Mn3 P6 O24",
            "formula_reduced": "Li3Mn(PO4)2",
            "formula_anonymous": "AB2C3D8",
            "energy": -304.3776016,
            "energy_per_atom": -7.247085752380952,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -282.8856016,
            "band_gap": 1.1956,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 12.0000996,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:58.567000Z",
            "spacegroup": 2
        },
        {
            "id": "mp-1178831",
            "created_at": "2022-09-04T14:42:00.948128Z",
            "structure_string": "V8 O14\n1.0\n6.734974 0.000000 0.000000\n-2.711326 7.545884 0.000000\n-1.569071 -1.816561 9.729208\nV O\n8 14\ndirect\n0.649830 0.751894 0.712893 V\n0.350170 0.248106 0.287107 V\n0.329865 0.905634 0.051130 V\n0.670135 0.094366 0.948870 V\n0.121040 0.496532 0.134219 V\n0.878960 0.503468 0.865781 V\n0.799232 0.461714 0.541959 V\n0.200768 0.538286 0.458041 V\n0.147130 0.652959 0.997107 O\n0.852870 0.347041 0.002893 O\n0.375672 0.678777 0.623102 O\n0.624328 0.321223 0.376898 O\n0.098924 0.605769 0.293985 O\n0.901076 0.394231 0.706015 O\n0.311273 0.382323 0.156879 O\n0.688727 0.617677 0.843121 O\n0.623807 0.955308 0.083637 O\n0.376193 0.044692 0.916363 O\n0.206766 0.305034 0.410513 O\n0.793234 0.694966 0.589487 O\n0.741190 0.977582 0.803422 O\n0.258810 0.022418 0.196578 O\n",
            "nsites": 22,
            "nelements": 2,
            "elements": [
                "V",
                "O"
            ],
            "chemical_system": "O-V",
            "density": 2.120875356319116,
            "density_atomic": 0.04449376374229227,
            "volume": 494.4513151870884,
            "volume_molar": 13.534797359198963,
            "formula_full": "V8 O14",
            "formula_reduced": "V4O7",
            "formula_anonymous": "A4B7",
            "energy": -188.41470606,
            "energy_per_atom": -8.56430482090909,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -165.19670606,
            "band_gap": 0.0,
            "is_gap_direct": true,
            "is_magnetic": true,
            "total_magnetization": 12.0000985,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:35.094000Z",
            "spacegroup": 2
        },
        {
            "id": "mp-26638",
            "created_at": "2022-09-04T14:46:21.100402Z",
            "structure_string": "Mo6 P8 O32\n1.0\n7.920946 0.000000 0.000000\n0.000000 7.798041 0.000000\n0.000000 0.880603 10.436714\nMo P O\n6 8 32\ndirect\n0.008396 0.762518 0.126262 Mo\n0.974372 0.764929 0.634928 Mo\n0.508396 0.237482 0.873738 Mo\n0.474372 0.235071 0.365072 Mo\n0.865977 0.355486 0.319363 Mo\n0.365977 0.644514 0.680637 Mo\n0.171374 0.544295 0.905688 P\n0.704534 0.442955 0.605518 P\n0.671374 0.455705 0.094312 P\n0.297574 0.047568 0.644808 P\n0.319432 0.038703 0.135428 P\n0.819432 0.961297 0.864572 P\n0.204534 0.557045 0.394482 P\n0.797574 0.952432 0.355192 P\n0.367013 0.173340 0.018723 O\n0.867013 0.826660 0.981277 O\n0.858790 0.841358 0.474682 O\n0.822266 0.845371 0.241055 O\n0.444251 0.901859 0.164376 O\n0.806133 0.829801 0.751290 O\n0.138855 0.680048 0.780370 O\n0.143143 0.691657 0.290706 O\n0.205678 0.647027 0.528197 O\n0.573331 0.589249 0.585492 O\n0.189622 0.661342 0.017099 O\n0.557888 0.603492 0.078548 O\n0.878669 0.517227 0.628922 O\n0.363714 0.496922 0.848610 O\n0.863714 0.503078 0.151390 O\n0.378669 0.482773 0.371078 O\n0.073331 0.410751 0.414508 O\n0.705678 0.352973 0.471803 O\n0.057888 0.396508 0.921452 O\n0.630652 0.013013 0.885358 O\n0.643143 0.308343 0.709294 O\n0.638855 0.319952 0.219630 O\n0.358790 0.158642 0.525318 O\n0.689622 0.338658 0.982901 O\n0.322266 0.154629 0.758945 O\n0.944251 0.098141 0.835624 O\n0.306133 0.170199 0.248710 O\n0.920193 0.114931 0.336456 O\n0.617203 0.013437 0.378060 O\n0.117203 0.986563 0.621940 O\n0.130652 0.986987 0.114642 O\n0.420193 0.885069 0.663544 O\n",
            "nsites": 46,
            "nelements": 3,
            "elements": [
                "Mo",
                "P",
                "O"
            ],
            "chemical_system": "Mo-O-P",
            "density": 3.4398354155240525,
            "density_atomic": 0.07135616192030622,
            "volume": 644.6535066078088,
            "volume_molar": 8.439552517869162,
            "formula_full": "Mo6 P8 O32",
            "formula_reduced": "Mo3(PO4)4",
            "formula_anonymous": "A3B4C16",
            "energy": -371.67777539,
            "energy_per_atom": -8.079951638913045,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -330.48177539,
            "band_gap": 1.5427,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 12.0000984,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:23.353000Z",
            "spacegroup": 4
        },
        {
            "id": "mp-28881",
            "created_at": "2022-09-04T14:47:10.736563Z",
            "structure_string": "Rb8 U4 Cl20\n1.0\n8.376025 0.000000 0.000000\n0.000000 9.010618 0.000000\n0.000000 0.000000 13.467131\nRb U Cl\n8 4 20\ndirect\n0.444042 0.505408 0.670048 Rb\n0.944042 0.494592 0.829952 Rb\n0.555958 0.005408 0.329952 Rb\n0.055958 0.994592 0.170048 Rb\n0.944042 0.005408 0.829952 Rb\n0.444042 0.994592 0.670048 Rb\n0.055958 0.505408 0.170048 Rb\n0.555958 0.494592 0.329952 Rb\n0.934218 0.750000 0.502683 U\n0.434218 0.250000 0.997317 U\n0.065782 0.250000 0.497317 U\n0.565782 0.750000 0.002683 U\n0.339562 0.959123 0.927963 Cl\n0.839562 0.040877 0.572037 Cl\n0.660438 0.459123 0.072037 Cl\n0.160438 0.540877 0.427963 Cl\n0.660438 0.040877 0.072037 Cl\n0.160438 0.959123 0.427963 Cl\n0.339562 0.540877 0.927963 Cl\n0.839562 0.459123 0.572037 Cl\n0.382761 0.750000 0.175620 Cl\n0.882761 0.250000 0.324380 Cl\n0.617239 0.250000 0.824380 Cl\n0.117239 0.750000 0.675620 Cl\n0.095245 0.250000 0.990275 Cl\n0.595245 0.750000 0.509725 Cl\n0.904755 0.750000 0.009725 Cl\n0.404755 0.250000 0.490275 Cl\n0.653239 0.750000 0.803103 Cl\n0.153239 0.250000 0.696897 Cl\n0.346761 0.250000 0.196897 Cl\n0.846761 0.750000 0.303103 Cl\n",
            "nsites": 32,
            "nelements": 3,
            "elements": [
                "Rb",
                "U",
                "Cl"
            ],
            "chemical_system": "Cl-Rb-U",
            "density": 3.8309734062547065,
            "density_atomic": 0.031483452422250445,
            "volume": 1016.406954701845,
            "volume_molar": 19.127955470804547,
            "formula_full": "Rb8 U4 Cl20",
            "formula_reduced": "Rb2UCl5",
            "formula_anonymous": "AB2C5",
            "energy": -162.32149429,
            "energy_per_atom": -5.0725466965625,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -150.04149429,
            "band_gap": 4.0098,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 12.0000978,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:59.120000Z",
            "spacegroup": 62
        },
        {
            "id": "mp-1194011",
            "created_at": "2022-09-04T14:42:21.635891Z",
            "structure_string": "S2 O24\n1.0\n3.830436 11.158869 0.000000\n-3.830436 11.158869 0.000000\n0.000000 1.982156 6.758287\nS O\n2 24\ndirect\n0.315800 0.905467 0.191915 S\n0.094533 0.684200 0.808085 S\n0.271164 0.161140 0.722603 O\n0.838860 0.728836 0.277397 O\n0.121417 0.048517 0.257899 O\n0.951483 0.878583 0.742101 O\n0.431291 0.898976 0.242075 O\n0.101024 0.568709 0.757925 O\n0.395197 0.766688 0.079335 O\n0.233312 0.604803 0.920665 O\n0.825292 0.471710 0.188119 O\n0.528290 0.174708 0.811881 O\n0.542462 0.155019 0.987953 O\n0.844981 0.457538 0.012047 O\n0.820371 0.102244 0.231923 O\n0.897756 0.179629 0.768077 O\n0.427148 0.493678 0.348430 O\n0.506322 0.572852 0.651570 O\n0.440191 0.720194 0.660449 O\n0.279806 0.559809 0.339551 O\n0.042686 0.119794 0.691943 O\n0.880206 0.957314 0.308057 O\n0.384523 0.155595 0.417205 O\n0.844405 0.615477 0.582795 O\n0.413770 0.085151 0.597313 O\n0.914849 0.586230 0.402687 O\n",
            "nsites": 26,
            "nelements": 2,
            "elements": [
                "S",
                "O"
            ],
            "chemical_system": "O-S",
            "density": 1.2879652464012517,
            "density_atomic": 0.04500267526346276,
            "volume": 577.7434307579744,
            "volume_molar": 13.381739473807057,
            "formula_full": "S2 O24",
            "formula_reduced": "SO12",
            "formula_anonymous": "AB12",
            "energy": -132.58869732,
            "energy_per_atom": -5.099565281538461,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -132.58869732,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 12.0000967,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:47.591000Z",
            "spacegroup": 5
        },
        {
            "id": "mp-849429",
            "created_at": "2022-09-04T14:44:28.185726Z",
            "structure_string": "Li6 Co4 O2 F10\n1.0\n0.000000 4.211951 8.877439\n2.996296 0.000000 8.877439\n2.996296 4.211951 0.000000\nLi Co O F\n6 4 2 10\ndirect\n0.250000 0.250000 0.250000 Li\n0.667949 0.667949 0.332051 Li\n0.000000 0.000000 0.000000 Li\n0.573133 0.573133 0.926867 Li\n0.926867 0.926867 0.573133 Li\n0.332051 0.332051 0.667949 Li\n0.750000 0.750000 0.750000 Co\n0.500000 0.500000 0.500000 Co\n0.173881 0.173881 0.826119 Co\n0.826119 0.826119 0.173881 Co\n0.509795 0.990205 0.509795 O\n0.990205 0.509795 0.990205 O\n0.915633 0.418620 0.577862 F\n0.264547 0.735453 0.264547 F\n0.818478 0.344571 0.142704 F\n0.418620 0.915633 0.087885 F\n0.344571 0.818478 0.694247 F\n0.735453 0.264547 0.735453 F\n0.142704 0.694247 0.818478 F\n0.577862 0.087885 0.915633 F\n0.694247 0.142704 0.344571 F\n0.087885 0.577862 0.418620 F\n",
            "nsites": 22,
            "nelements": 4,
            "elements": [
                "Li",
                "Co",
                "O",
                "F"
            ],
            "chemical_system": "Co-F-Li-O",
            "density": 3.700654441909442,
            "density_atomic": 0.09818315051858396,
            "volume": 224.07103340848562,
            "volume_molar": 6.133578651929831,
            "formula_full": "Li6 Co4 O2 F10",
            "formula_reduced": "Li3Co2OF5",
            "formula_anonymous": "AB2C3D5",
            "energy": -123.94232064,
            "energy_per_atom": -5.633741847272727,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -111.39632064,
            "band_gap": 1.5356,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 12.0000964,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:38.441000Z",
            "spacegroup": 22
        },
        {
            "id": "mp-1040979",
            "created_at": "2022-09-04T14:46:02.155808Z",
            "structure_string": "Zn6 Ni12 O24\n1.0\n5.866488 0.000000 0.000000\n2.864001 5.128005 0.000000\n0.209553 0.212018 14.380847\nZn Ni O\n6 12 24\ndirect\n0.159040 0.175606 0.044447 Zn\n0.500730 0.499229 0.378627 Zn\n0.503195 0.498976 0.998940 Zn\n0.819179 0.849205 0.709388 Zn\n0.163109 0.165192 0.288454 Zn\n0.509821 0.494567 0.624156 Zn\n0.165773 0.666343 0.166821 Ni\n0.664769 0.667107 0.166954 Ni\n0.501828 0.995759 0.501430 Ni\n0.665220 0.165545 0.168031 Ni\n0.831464 0.830387 0.335421 Ni\n0.003913 0.995503 0.500067 Ni\n0.834814 0.337755 0.832005 Ni\n0.003353 0.497247 0.500204 Ni\n0.331523 0.835147 0.832824 Ni\n0.163923 0.174942 0.665830 Ni\n0.330249 0.336890 0.832039 Ni\n0.842504 0.821186 0.954895 Ni\n0.348636 0.345484 0.096242 O\n0.505789 0.511221 0.241652 O\n0.345522 0.810308 0.091221 O\n0.801985 0.351395 0.094966 O\n0.532717 0.979150 0.243710 O\n0.664682 0.695215 0.427356 O\n0.979353 0.532427 0.243215 O\n0.825313 0.820381 0.089864 O\n0.689952 0.133280 0.426075 O\n0.853630 0.823397 0.572544 O\n0.981780 0.980420 0.240025 O\n0.135896 0.662455 0.420320 O\n0.876315 0.326783 0.581532 O\n0.997236 0.044546 0.752205 O\n0.314517 0.858998 0.576134 O\n0.152449 0.170757 0.427320 O\n0.147965 0.177343 0.905453 O\n0.001986 0.483381 0.757644 O\n0.336794 0.296962 0.578533 O\n0.451115 0.043303 0.750482 O\n0.195403 0.632183 0.909496 O\n0.520394 0.493175 0.761793 O\n0.669495 0.185703 0.904498 O\n0.676670 0.635150 0.907185 O\n",
            "nsites": 42,
            "nelements": 3,
            "elements": [
                "Zn",
                "Ni",
                "O"
            ],
            "chemical_system": "Ni-O-Zn",
            "density": 5.683590721829489,
            "density_atomic": 0.09708188449383497,
            "volume": 432.6244820954948,
            "volume_molar": 6.203156017621833,
            "formula_full": "Zn6 Ni12 O24",
            "formula_reduced": "Zn(NiO2)2",
            "formula_anonymous": "AB2C4",
            "energy": -246.07482467,
            "energy_per_atom": -5.8589243969047615,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -199.09482467,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 12.0000959,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:17.738000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-36843",
            "created_at": "2022-09-04T14:44:09.579469Z",
            "structure_string": "Mn4 Ni2 O8\n1.0\n2.995040 1.729194 4.890906\n3.034285 -1.722392 -4.917365\n-3.008772 5.211343 0.000009\nMn Ni O\n4 2 8\ndirect\n0.990043 0.980080 0.990040 Mn\n0.759948 0.519902 0.259951 Mn\n0.374995 0.249990 0.624997 Mn\n0.875006 0.250011 0.625003 Mn\n0.375003 0.750005 0.625002 Ni\n0.375002 0.750005 0.125003 Ni\n0.168477 0.798885 0.399443 O\n0.630403 0.798885 0.399443 O\n0.119599 0.701116 0.850558 O\n0.581521 0.701116 0.850558 O\n0.622466 0.244935 0.839787 O\n0.622466 0.244935 0.405148 O\n0.127535 0.255068 0.844854 O\n0.127535 0.255067 0.410213 O\n",
            "nsites": 14,
            "nelements": 3,
            "elements": [
                "Mn",
                "Ni",
                "O"
            ],
            "chemical_system": "Mn-Ni-O",
            "density": 5.004778268478573,
            "density_atomic": 0.09071634103968801,
            "volume": 154.3272120496467,
            "volume_molar": 6.638429957581003,
            "formula_full": "Mn4 Ni2 O8",
            "formula_reduced": "Mn2NiO4",
            "formula_anonymous": "AB2C4",
            "energy": -112.63511741,
            "energy_per_atom": -8.045365529285714,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -95.38511741,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 12.0000957,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:30.009000Z",
            "spacegroup": 74
        }
    ]
}