GET /third-parties/MatprojStructure/?format=api&ordering=formation_energy&page=12139
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=formation_energy&page=12140",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=formation_energy&page=12138",
    "results": [
        {
            "id": "mp-600151",
            "created_at": "2022-09-04T14:39:49.574341Z",
            "structure_string": "K2 Na4 Al2 H12\n1.0\n4.606333 0.000000 0.000000\n0.000000 7.015624 0.000000\n0.000000 1.124999 10.994639\nK Na Al H\n2 4 2 12\ndirect\n0.476401 0.648570 0.235741 K\n0.976401 0.351430 0.764259 K\n0.568205 0.807234 0.799851 Na\n0.656321 0.097561 0.415979 Na\n0.068205 0.192766 0.200149 Na\n0.156321 0.902439 0.584021 Na\n0.486540 0.096149 0.990176 Al\n0.986540 0.903851 0.009824 Al\n0.139770 0.506718 0.445496 H\n0.474556 0.218007 0.851787 H\n0.728282 0.448642 0.506419 H\n0.973717 0.731805 0.915118 H\n0.639770 0.493282 0.554504 H\n0.228282 0.551358 0.493581 H\n0.974556 0.781993 0.148213 H\n0.698049 0.021080 0.620591 H\n0.288158 0.646818 0.692013 H\n0.198049 0.978920 0.379409 H\n0.788158 0.353182 0.307987 H\n0.473717 0.268195 0.084882 H\n",
            "nsites": 20,
            "nelements": 4,
            "elements": [
                "K",
                "Na",
                "Al",
                "H"
            ],
            "chemical_system": "Al-H-K-Na",
            "density": 1.1039570682849165,
            "density_atomic": 0.056289499306377784,
            "volume": 355.3060561285528,
            "volume_molar": 10.69851541443303,
            "formula_full": "K2 Na4 Al2 H12",
            "formula_reduced": "KNa2AlH6",
            "formula_anonymous": "ABC2D6",
            "energy": -58.83832865,
            "energy_per_atom": -2.9419164325000002,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -56.69032865,
            "band_gap": 2.427,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0016509,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:28.054000Z",
            "spacegroup": 4
        },
        {
            "id": "mp-754317",
            "created_at": "2022-09-04T14:39:49.797937Z",
            "structure_string": "Nd2 O4\n1.0\n3.790397 0.000000 0.000000\n0.000000 5.277331 0.000000\n0.000000 0.000000 5.444522\nNd O\n2 4\ndirect\n0.000000 0.500000 0.000000 Nd\n0.500000 0.000000 0.500000 Nd\n0.000000 0.820369 0.297119 O\n0.000000 0.179631 0.702881 O\n0.500000 0.320369 0.202881 O\n0.500000 0.679631 0.797119 O\n",
            "nsites": 6,
            "nelements": 2,
            "elements": [
                "Nd",
                "O"
            ],
            "chemical_system": "Nd-O",
            "density": 5.374360041436059,
            "density_atomic": 0.05509249732575901,
            "volume": 108.90775134992191,
            "volume_molar": 10.930963474738498,
            "formula_full": "Nd2 O4",
            "formula_reduced": "NdO2",
            "formula_anonymous": "AB2",
            "energy": -46.44207444,
            "energy_per_atom": -7.7403457399999995,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -43.69407444,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 2.0002584,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:31.950000Z",
            "spacegroup": 58
        },
        {
            "id": "mp-1196387",
            "created_at": "2022-09-04T14:39:49.539724Z",
            "structure_string": "W24 I64\n1.0\n14.462604 0.000000 0.000000\n0.000000 15.888361 0.000000\n0.000000 4.200626 16.170577\nW I\n24 64\ndirect\n0.776316 0.633483 0.095733 W\n0.276316 0.366517 0.404267 W\n0.223684 0.366517 0.904267 W\n0.723684 0.633483 0.595733 W\n0.643125 0.539645 0.156034 W\n0.143125 0.460355 0.343966 W\n0.356875 0.460355 0.843966 W\n0.856875 0.539645 0.656034 W\n0.624142 0.698681 0.118861 W\n0.124142 0.301319 0.381139 W\n0.375858 0.301319 0.881139 W\n0.875858 0.698681 0.618861 W\n0.664965 0.207444 0.284651 W\n0.164965 0.792556 0.215349 W\n0.335035 0.792556 0.715349 W\n0.835035 0.207444 0.784651 W\n0.670292 0.045890 0.328174 W\n0.170292 0.954110 0.171826 W\n0.329708 0.954110 0.671826 W\n0.829708 0.045890 0.828174 W\n0.808211 0.135374 0.342251 W\n0.308211 0.864626 0.157749 W\n0.191789 0.864626 0.657749 W\n0.691789 0.135374 0.842251 W\n0.806850 0.509325 0.245638 I\n0.306850 0.490675 0.254362 I\n0.193150 0.490675 0.754362 I\n0.693150 0.509325 0.745638 I\n0.573122 0.611490 0.279479 I\n0.073122 0.388510 0.220521 I\n0.426878 0.388510 0.720521 I\n0.926878 0.611490 0.779479 I\n0.779689 0.761081 0.184567 I\n0.279689 0.238919 0.315433 I\n0.220311 0.238919 0.815433 I\n0.720311 0.761081 0.684567 I\n0.729390 0.501193 0.019397 I\n0.229390 0.498807 0.480603 I\n0.270610 0.498807 0.980603 I\n0.770610 0.501193 0.519397 I\n0.493168 0.605847 0.054035 I\n0.993168 0.394153 0.445965 I\n0.506832 0.394153 0.945965 I\n0.006832 0.605847 0.554035 I\n0.700459 0.753846 0.961019 I\n0.200459 0.246154 0.538981 I\n0.299541 0.246154 0.038981 I\n0.799541 0.753846 0.461019 I\n0.958399 0.642859 0.041054 I\n0.458399 0.357141 0.458946 I\n0.041601 0.357141 0.958946 I\n0.541601 0.642859 0.541054 I\n0.558848 0.366683 0.212858 I\n0.058848 0.633317 0.287142 I\n0.441152 0.633317 0.787142 I\n0.941152 0.366683 0.712858 I\n0.503077 0.855740 0.101491 I\n0.003077 0.144260 0.398509 I\n0.496923 0.144260 0.898509 I\n0.996923 0.855740 0.601491 I\n0.526928 0.125738 0.393899 I\n0.026928 0.874262 0.106101 I\n0.473072 0.874262 0.606101 I\n0.973072 0.125738 0.893899 I\n0.754646 0.009515 0.483492 I\n0.254646 0.990485 0.016508 I\n0.245354 0.990485 0.516508 I\n0.745354 0.009515 0.983492 I\n0.740857 0.261969 0.416541 I\n0.240857 0.738031 0.083459 I\n0.259143 0.738031 0.583459 I\n0.759143 0.261969 0.916541 I\n0.604789 0.121916 0.167584 I\n0.104789 0.878084 0.332416 I\n0.395211 0.878084 0.832416 I\n0.895211 0.121916 0.667584 I\n0.837150 0.005459 0.260305 I\n0.337150 0.994541 0.239695 I\n0.162850 0.994541 0.739695 I\n0.662850 0.005459 0.760305 I\n0.825001 0.256194 0.190239 I\n0.325001 0.743806 0.309761 I\n0.174999 0.743806 0.809761 I\n0.674999 0.256194 0.690239 I\n0.583813 0.885362 0.345487 I\n0.083813 0.114638 0.154513 I\n0.416187 0.114638 0.654513 I\n0.916187 0.885362 0.845487 I\n",
            "nsites": 88,
            "nelements": 2,
            "elements": [
                "W",
                "I"
            ],
            "chemical_system": "I-W",
            "density": 5.601305677879843,
            "density_atomic": 0.023682718975930432,
            "volume": 3715.7895632438763,
            "volume_molar": 25.428417936810845,
            "formula_full": "W24 I64",
            "formula_reduced": "W3I8",
            "formula_anonymous": "A3B8",
            "energy": -443.12578853,
            "energy_per_atom": -5.035520324204546,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -418.86978853,
            "band_gap": 1.064,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0226043,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:37.166000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-722346",
            "created_at": "2022-09-04T14:39:49.547208Z",
            "structure_string": "K2 Yb2 P8 H16 O36\n1.0\n6.029863 4.303857 0.000000\n-6.029863 4.303857 0.000000\n0.000000 0.055815 15.133569\nK Yb P H O\n2 2 8 16 36\ndirect\n0.446639 0.553361 0.750000 K\n0.553361 0.446639 0.250000 K\n0.110414 0.889586 0.750000 Yb\n0.889586 0.110414 0.250000 Yb\n0.021598 0.209936 0.584030 P\n0.790064 0.978402 0.915970 P\n0.978402 0.790063 0.415970 P\n0.209936 0.021598 0.084030 P\n0.183764 0.245726 0.925064 P\n0.754274 0.816236 0.574936 P\n0.816236 0.754274 0.074936 P\n0.245726 0.183764 0.425064 P\n0.244127 0.670709 0.898467 H\n0.329291 0.755873 0.601533 H\n0.755873 0.329291 0.101533 H\n0.670709 0.244127 0.398467 H\n0.121727 0.601069 0.613493 H\n0.398931 0.878273 0.886507 H\n0.878273 0.398931 0.386507 H\n0.601069 0.121727 0.113493 H\n0.885883 0.488054 0.828568 H\n0.511946 0.114117 0.671432 H\n0.114117 0.511946 0.171432 H\n0.488054 0.885883 0.328568 H\n0.938877 0.458133 0.727026 H\n0.541867 0.061123 0.772974 H\n0.061123 0.541867 0.272974 H\n0.458133 0.938877 0.227026 H\n0.960166 0.160922 0.952241 O\n0.839078 0.039834 0.547759 O\n0.039834 0.839078 0.047759 O\n0.160922 0.960166 0.452241 O\n0.140180 0.283264 0.494071 O\n0.716737 0.859820 0.005929 O\n0.859820 0.716737 0.505929 O\n0.283263 0.140180 0.994071 O\n0.862582 0.861390 0.853331 O\n0.138610 0.137418 0.646669 O\n0.137418 0.138610 0.146669 O\n0.861390 0.862582 0.353331 O\n0.950658 0.368805 0.614403 O\n0.631195 0.049342 0.885597 O\n0.049342 0.631195 0.385597 O\n0.368805 0.950658 0.114403 O\n0.811811 0.783530 0.666530 O\n0.216470 0.188189 0.833470 O\n0.188189 0.216470 0.333470 O\n0.783530 0.811811 0.166530 O\n0.248418 0.456834 0.945635 O\n0.543166 0.751582 0.554365 O\n0.751582 0.543166 0.054365 O\n0.456834 0.248418 0.445635 O\n0.211717 0.719759 0.637946 O\n0.280241 0.788283 0.862054 O\n0.788283 0.280241 0.362054 O\n0.719759 0.211717 0.137946 O\n0.680332 0.420844 0.895095 O\n0.579156 0.319668 0.604905 O\n0.319668 0.579156 0.104905 O\n0.420844 0.680332 0.395095 O\n0.970673 0.544754 0.778179 O\n0.455246 0.029327 0.721821 O\n0.029327 0.455246 0.221821 O\n0.544754 0.970673 0.278179 O\n",
            "nsites": 64,
            "nelements": 5,
            "elements": [
                "K",
                "Yb",
                "P",
                "H",
                "O"
            ],
            "chemical_system": "H-K-O-P-Yb",
            "density": 2.67250592220735,
            "density_atomic": 0.0814785589029782,
            "volume": 785.48271915571,
            "volume_molar": 7.391074217661303,
            "formula_full": "K2 Yb2 P8 H16 O36",
            "formula_reduced": "KYbP4(H4O9)2",
            "formula_anonymous": "ABC4D8E18",
            "energy": -399.97846632000005,
            "energy_per_atom": -6.249663536250001,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -375.24646632,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 10.0063758,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:32.470000Z",
            "spacegroup": 15
        },
        {
            "id": "mp-1195485",
            "created_at": "2022-09-04T14:39:49.552354Z",
            "structure_string": "Ag4 I12 O32\n1.0\n0.000000 -8.242784 0.000000\n-8.266580 0.000000 0.000000\n0.000000 0.000000 -12.047963\nAg I O\n4 12 32\ndirect\n0.500000 0.000000 0.032752 Ag\n0.000000 0.000000 0.532752 Ag\n0.500000 0.500000 0.002751 Ag\n0.000000 0.500000 0.502751 Ag\n0.720851 0.247993 0.826641 I\n0.279149 0.752007 0.826641 I\n0.220852 0.752007 0.326641 I\n0.779149 0.247993 0.326641 I\n0.000000 0.000000 0.952094 I\n0.500000 0.000000 0.452094 I\n0.745415 0.771385 0.207979 I\n0.254585 0.228615 0.207979 I\n0.245415 0.228615 0.707979 I\n0.754585 0.771385 0.707979 I\n0.000000 0.500000 0.078987 I\n0.500000 0.500000 0.578987 I\n0.759955 0.425715 0.912293 O\n0.240045 0.574285 0.912293 O\n0.259955 0.574285 0.412293 O\n0.740045 0.425715 0.412293 O\n0.504508 0.230090 0.851224 O\n0.495492 0.769910 0.851224 O\n0.004508 0.769910 0.351224 O\n0.995492 0.230090 0.351224 O\n0.762113 0.085364 0.942989 O\n0.237887 0.914636 0.942989 O\n0.262113 0.914636 0.442989 O\n0.737887 0.085364 0.442989 O\n0.048051 0.167281 0.856796 O\n0.951949 0.832719 0.856796 O\n0.548051 0.832719 0.356796 O\n0.451949 0.167281 0.356796 O\n0.567770 0.732461 0.121496 O\n0.432230 0.267539 0.121496 O\n0.067770 0.267539 0.621496 O\n0.932230 0.732461 0.621496 O\n0.761720 0.987340 0.185563 O\n0.238280 0.012660 0.185563 O\n0.261720 0.012660 0.685563 O\n0.738280 0.987340 0.685563 O\n0.908453 0.733105 0.090582 O\n0.091547 0.266895 0.090582 O\n0.408453 0.266895 0.590582 O\n0.591547 0.733105 0.590582 O\n0.833172 0.444975 0.173200 O\n0.166828 0.555025 0.173200 O\n0.333172 0.555025 0.673200 O\n0.666828 0.444975 0.673200 O\n",
            "nsites": 48,
            "nelements": 3,
            "elements": [
                "Ag",
                "I",
                "O"
            ],
            "chemical_system": "Ag-I-O",
            "density": 4.988647961470367,
            "density_atomic": 0.05846928995550824,
            "volume": 820.9437815394241,
            "volume_molar": 10.299664600993964,
            "formula_full": "Ag4 I12 O32",
            "formula_reduced": "AgI3O8",
            "formula_anonymous": "AB3C8",
            "energy": -224.12166839,
            "energy_per_atom": -4.669201424791667,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -202.13766839,
            "band_gap": 2.279,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.003799,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:28.154000Z",
            "spacegroup": 30
        },
        {
            "id": "mp-1184964",
            "created_at": "2022-09-04T14:39:49.555183Z",
            "structure_string": "La1 Mg1 O3\n1.0\n3.945789 0.000000 0.000000\n0.000000 3.945789 0.000000\n0.000000 0.000000 3.945789\nLa Mg O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 Mg\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
            "nsites": 5,
            "nelements": 3,
            "elements": [
                "La",
                "Mg",
                "O"
            ],
            "chemical_system": "La-Mg-O",
            "density": 5.708989785524037,
            "density_atomic": 0.08138950947825455,
            "volume": 61.43297867320221,
            "volume_molar": 7.3991608975220355,
            "formula_full": "La1 Mg1 O3",
            "formula_reduced": "LaMgO3",
            "formula_anonymous": "ABC3",
            "energy": -36.12709505,
            "energy_per_atom": -7.22541901,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -34.06609505,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 1.0015996,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:44.987000Z",
            "spacegroup": 221
        },
        {
            "id": "mp-769487",
            "created_at": "2022-09-04T14:39:49.561767Z",
            "structure_string": "Li8 Ti8 V10 O36\n1.0\n2.973393 0.000000 0.000000\n0.000000 9.148529 0.000000\n0.000000 0.000000 25.377185\nLi Ti V O\n8 8 10 36\ndirect\n0.000000 0.692419 0.990335 Li\n0.000000 0.682122 0.201276 Li\n0.000000 0.817878 0.701276 Li\n0.000000 0.807581 0.490335 Li\n0.000000 0.192419 0.509665 Li\n0.000000 0.182122 0.298724 Li\n0.000000 0.317878 0.798724 Li\n0.000000 0.307581 0.009665 Li\n0.000000 0.502935 0.102127 Ti\n0.500000 0.647483 0.805167 Ti\n0.500000 0.852517 0.305167 Ti\n0.000000 0.997065 0.602127 Ti\n0.000000 0.002935 0.397873 Ti\n0.500000 0.147483 0.694833 Ti\n0.500000 0.352517 0.194833 Ti\n0.000000 0.497065 0.897873 Ti\n0.000000 0.500000 0.500000 V\n0.000000 0.517636 0.309766 V\n0.500000 0.646195 0.585384 V\n0.500000 0.853805 0.085384 V\n0.000000 0.982364 0.809766 V\n0.000000 0.000000 0.000000 V\n0.000000 0.017636 0.190234 V\n0.500000 0.146195 0.914616 V\n0.500000 0.353805 0.414616 V\n0.000000 0.482364 0.690234 V\n0.000000 0.499918 0.425215 O\n0.000000 0.500082 0.574785 O\n0.500000 0.558069 0.940444 O\n0.500000 0.549908 0.158649 O\n0.500000 0.603897 0.662494 O\n0.000000 0.594806 0.757672 O\n0.500000 0.648399 0.504034 O\n0.500000 0.650719 0.282221 O\n0.000000 0.685725 0.853894 O\n0.000000 0.701428 0.082747 O\n0.000000 0.798572 0.582747 O\n0.000000 0.814275 0.353894 O\n0.500000 0.849281 0.782221 O\n0.500000 0.851601 0.004034 O\n0.000000 0.905194 0.257672 O\n0.500000 0.896103 0.162494 O\n0.500000 0.950092 0.658649 O\n0.500000 0.941931 0.440444 O\n0.000000 0.999918 0.074785 O\n0.000000 0.000082 0.925215 O\n0.500000 0.058069 0.559556 O\n0.500000 0.049908 0.341351 O\n0.500000 0.103897 0.837506 O\n0.000000 0.094806 0.742328 O\n0.500000 0.148399 0.995966 O\n0.500000 0.150719 0.217779 O\n0.000000 0.185725 0.646106 O\n0.000000 0.201428 0.417253 O\n0.000000 0.298572 0.917253 O\n0.000000 0.314275 0.146106 O\n0.500000 0.349281 0.717779 O\n0.500000 0.351601 0.495966 O\n0.000000 0.405194 0.242328 O\n0.500000 0.396103 0.337506 O\n0.500000 0.450092 0.841351 O\n0.500000 0.441931 0.059556 O\n",
            "nsites": 62,
            "nelements": 4,
            "elements": [
                "Li",
                "Ti",
                "V",
                "O"
            ],
            "chemical_system": "Li-O-Ti-V",
            "density": 3.665611179412855,
            "density_atomic": 0.0898141284802574,
            "volume": 690.3145535017757,
            "volume_molar": 6.705115177200393,
            "formula_full": "Li8 Ti8 V10 O36",
            "formula_reduced": "Li4Ti4V5O18",
            "formula_anonymous": "A4B4C5D18",
            "energy": -522.13424744,
            "energy_per_atom": -8.42152012,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -480.40224744,
            "band_gap": 0.8845999999999998,
            "is_gap_direct": true,
            "is_magnetic": true,
            "total_magnetization": 17.9900155,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:37.447000Z",
            "spacegroup": 55
        },
        {
            "id": "mp-765593",
            "created_at": "2022-09-04T14:39:49.582794Z",
            "structure_string": "Li4 Fe4 P4 O16\n1.0\n5.764234 -0.000017 -0.000004\n-0.000017 5.763946 0.000012\n-0.000006 0.000016 8.124612\nLi Fe P O\n4 4 4 16\ndirect\n0.999999 0.224277 0.000002 Li\n0.000000 0.775726 0.500001 Li\n0.224279 0.000000 0.250001 Li\n0.775719 0.999999 0.750002 Li\n0.500007 0.237350 0.999978 Fe\n0.500002 0.762642 0.500005 Fe\n0.237364 0.499999 0.250003 Fe\n0.762642 0.499995 0.750000 Fe\n0.251109 0.251113 0.624998 P\n0.251109 0.748886 0.875004 P\n0.748890 0.251116 0.375005 P\n0.748892 0.748883 0.124997 P\n0.969459 0.251286 0.264233 O\n0.969461 0.748713 0.235773 O\n0.251283 0.969476 0.985782 O\n0.251279 0.030526 0.514214 O\n0.748716 0.969476 0.014218 O\n0.748712 0.030523 0.485782 O\n0.030540 0.251288 0.735772 O\n0.030541 0.748714 0.764229 O\n0.252652 0.475006 0.513035 O\n0.252651 0.524995 0.986969 O\n0.525013 0.252659 0.263047 O\n0.525017 0.747349 0.236955 O\n0.474985 0.252655 0.736950 O\n0.474987 0.747352 0.763047 O\n0.747348 0.475004 0.486962 O\n0.747343 0.524993 0.013034 O\n",
            "nsites": 28,
            "nelements": 4,
            "elements": [
                "Li",
                "Fe",
                "P",
                "O"
            ],
            "chemical_system": "Fe-Li-O-P",
            "density": 3.881812803280282,
            "density_atomic": 0.10372749627609648,
            "volume": 269.93806854713864,
            "volume_molar": 5.805732304547848,
            "formula_full": "Li4 Fe4 P4 O16",
            "formula_reduced": "LiFePO4",
            "formula_anonymous": "ABCD4",
            "energy": -209.31870665,
            "energy_per_atom": -7.475668094642857,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -189.30270665,
            "band_gap": 3.1914,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:42.640000Z",
            "spacegroup": 95
        },
        {
            "id": "mp-1234588",
            "created_at": "2022-09-04T14:39:49.591115Z",
            "structure_string": "Mg1 V12 B4 O20\n1.0\n0.000000 -0.000000 3.173537\n9.753340 0.089328 -0.000000\n0.118461 12.977377 0.000000\nMg V B O\n1 12 4 20\ndirect\n0.499999 0.240220 0.767458 Mg\n0.500000 0.013745 0.218162 V\n0.500000 0.962501 0.772702 V\n0.500000 0.512984 0.725432 V\n0.500000 0.512963 0.280220 V\n0.500000 0.994386 0.488604 V\n0.500000 0.513857 0.006166 V\n0.000000 0.249877 0.382705 V\n1.000000 0.751200 0.602670 V\n1.000000 0.258366 0.929284 V\n0.000000 0.750996 0.117373 V\n1.000000 0.989045 0.996294 V\n0.000000 0.498306 0.496996 V\n0.000000 0.289582 0.147137 B\n0.000000 0.720088 0.862129 B\n0.000000 0.209722 0.622231 B\n0.000000 0.778821 0.355685 B\n0.000000 0.373668 0.057753 O\n1.000000 0.655900 0.957475 O\n1.000000 0.149884 0.530369 O\n1.000000 0.847335 0.449019 O\n1.000000 0.146947 0.137785 O\n1.000000 0.863962 0.857365 O\n0.000001 0.350529 0.645510 O\n0.000000 0.635063 0.356030 O\n0.500000 0.121454 0.354887 O\n0.500000 0.879705 0.630906 O\n0.500000 0.386423 0.867158 O\n0.500000 0.627136 0.140682 O\n0.000000 0.357203 0.239766 O\n0.000000 0.649283 0.768961 O\n0.999999 0.127906 0.716396 O\n0.000000 0.854224 0.262588 O\n0.500000 0.394196 0.421096 O\n0.500000 0.598736 0.577685 O\n0.500000 0.107240 0.908247 O\n0.500000 0.897381 0.078240 O\n",
            "nsites": 37,
            "nelements": 4,
            "elements": [
                "Mg",
                "V",
                "B",
                "O"
            ],
            "chemical_system": "B-Mg-O-V",
            "density": 4.129479438738368,
            "density_atomic": 0.09212005374315893,
            "volume": 401.64978738679594,
            "volume_molar": 6.537274475317183,
            "formula_full": "Mg1 V12 B4 O20",
            "formula_reduced": "MgV12(BO5)4",
            "formula_anonymous": "AB4C12D20",
            "energy": -322.0587899,
            "energy_per_atom": -8.70429161891892,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -287.9187899,
            "band_gap": 0.0002000000000004,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 34.0000012,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:40.107000Z",
            "spacegroup": 6
        },
        {
            "id": "mp-764933",
            "created_at": "2022-09-04T14:39:49.599876Z",
            "structure_string": "Li10 Mn2 Fe3 Ni3 O16\n1.0\n2.991983 5.145439 0.000000\n-2.991983 5.145439 0.000000\n0.000000 0.142953 9.785532\nLi Mn Fe Ni O\n10 2 3 3 16\ndirect\n0.607950 0.199309 0.051230 Li\n0.199309 0.607950 0.051230 Li\n0.327622 0.327622 0.266938 Li\n0.196124 0.196124 0.048294 Li\n0.995769 0.995769 0.980572 Li\n0.995521 0.995521 0.476088 Li\n0.801356 0.801356 0.545009 Li\n0.804321 0.388897 0.539400 Li\n0.657332 0.657332 0.767755 Li\n0.388897 0.804321 0.539400 Li\n0.326618 0.326618 0.521517 Mn\n0.660794 0.660794 0.023937 Mn\n0.652765 0.164812 0.778371 Fe\n0.164812 0.652765 0.778371 Fe\n0.822473 0.822473 0.276086 Fe\n0.160770 0.160770 0.778342 Ni\n0.828418 0.334835 0.279426 Ni\n0.334835 0.828418 0.279426 Ni\n0.651293 0.162350 0.407669 O\n0.481737 0.481737 0.648448 O\n0.992878 0.992878 0.172873 O\n0.482872 0.024004 0.649072 O\n0.162350 0.651293 0.407669 O\n0.330682 0.330682 0.896295 O\n0.987004 0.987004 0.667481 O\n0.024004 0.482872 0.649072 O\n0.168020 0.168020 0.414170 O\n0.994159 0.503322 0.157597 O\n0.822582 0.822582 0.898820 O\n0.503322 0.994159 0.157597 O\n0.666196 0.666196 0.398361 O\n0.815114 0.327490 0.898457 O\n0.512620 0.512620 0.147910 O\n0.327490 0.815114 0.898457 O\n",
            "nsites": 34,
            "nelements": 5,
            "elements": [
                "Li",
                "Mn",
                "Fe",
                "Ni",
                "O"
            ],
            "chemical_system": "Fe-Li-Mn-Ni-O",
            "density": 4.292696409593069,
            "density_atomic": 0.112845156806499,
            "volume": 301.29782227429956,
            "volume_molar": 5.336640871815574,
            "formula_full": "Li10 Mn2 Fe3 Ni3 O16",
            "formula_reduced": "Li10Mn2Fe3Ni3O16",
            "formula_anonymous": "A2B3C3D10E16",
            "energy": -222.05250441,
            "energy_per_atom": -6.530956012058824,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -193.33350441,
            "band_gap": 0.4317999999999999,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 28.0000001,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:43.279000Z",
            "spacegroup": 8
        },
        {
            "id": "mp-851082",
            "created_at": "2022-09-04T14:39:49.620346Z",
            "structure_string": "Mn15 Ni1 O32\n1.0\n5.811356 -5.835581 0.000000\n5.811356 5.835581 0.000000\n-0.048550 0.000000 8.235503\nMn Ni O\n15 1 32\ndirect\n0.999431 0.248792 0.248792 Mn\n0.000000 0.500000 0.500000 Mn\n0.000569 0.751208 0.751208 Mn\n0.750503 0.500000 0.249497 Mn\n0.750503 0.249497 0.500000 Mn\n0.751208 0.751208 0.000569 Mn\n0.751208 0.000569 0.751208 Mn\n0.500000 0.500000 0.000000 Mn\n0.500000 0.249497 0.750503 Mn\n0.500000 0.750503 0.249497 Mn\n0.500000 0.000000 0.500000 Mn\n0.248792 0.248792 0.999431 Mn\n0.249497 0.500000 0.750503 Mn\n0.248792 0.999431 0.248792 Mn\n0.249497 0.750503 0.500000 Mn\n0.000000 0.000000 0.000000 Ni\n0.013882 0.231332 0.013882 O\n0.013882 0.013882 0.231332 O\n0.014250 0.736099 0.514994 O\n0.014250 0.514994 0.736099 O\n0.985750 0.263901 0.485006 O\n0.985750 0.485006 0.263901 O\n0.986118 0.768668 0.986118 O\n0.986118 0.986118 0.768668 O\n0.764242 0.264236 0.264236 O\n0.765046 0.485094 0.485094 O\n0.764830 0.764830 0.764830 O\n0.768668 0.986118 0.986118 O\n0.735764 0.735764 0.235758 O\n0.736099 0.514994 0.014250 O\n0.735764 0.235758 0.735764 O\n0.736099 0.014250 0.514994 O\n0.514906 0.514906 0.234954 O\n0.514994 0.736099 0.014250 O\n0.514994 0.014250 0.736099 O\n0.514906 0.234954 0.514906 O\n0.485094 0.485094 0.765046 O\n0.485006 0.263901 0.985750 O\n0.485006 0.985750 0.263901 O\n0.485094 0.765046 0.485094 O\n0.263901 0.485006 0.985750 O\n0.264236 0.264236 0.764242 O\n0.263901 0.985750 0.485006 O\n0.264236 0.764242 0.264236 O\n0.231332 0.013882 0.013882 O\n0.235170 0.235170 0.235170 O\n0.234954 0.514906 0.514906 O\n0.235758 0.735764 0.735764 O\n",
            "nsites": 48,
            "nelements": 3,
            "elements": [
                "Mn",
                "Ni",
                "O"
            ],
            "chemical_system": "Mn-Ni-O",
            "density": 4.146313768845887,
            "density_atomic": 0.08593291211539753,
            "volume": 558.5752748090487,
            "volume_molar": 7.007956104074528,
            "formula_full": "Mn15 Ni1 O32",
            "formula_reduced": "Mn15NiO32",
            "formula_anonymous": "AB15C32",
            "energy": -383.23524102,
            "energy_per_atom": -7.98406752125,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -333.69024102,
            "band_gap": 0.6348999999999999,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 45.0005403,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:35.008000Z",
            "spacegroup": 166
        },
        {
            "id": "mp-1380645",
            "created_at": "2022-09-04T14:39:49.643370Z",
            "structure_string": "Ca4 Sn4 As4 O20\n1.0\n6.223353 0.000000 0.000000\n0.000000 7.956349 0.000000\n0.000000 1.125937 9.443191\nCa Sn As O\n4 4 4 20\ndirect\n0.766638 0.061448 0.640757 Ca\n0.247502 0.401382 0.177019 Ca\n0.747502 0.598618 0.822981 Ca\n0.266638 0.938552 0.359243 Ca\n0.479245 0.010637 0.990447 Sn\n0.523318 0.492589 0.496810 Sn\n0.023318 0.507411 0.503190 Sn\n0.979245 0.989363 0.009553 Sn\n0.281930 0.388349 0.829198 As\n0.711430 0.169569 0.287275 As\n0.211430 0.830431 0.712725 As\n0.781930 0.611651 0.170802 As\n0.224182 0.192596 0.929111 O\n0.787290 0.331538 0.502307 O\n0.287290 0.668462 0.497693 O\n0.724182 0.807404 0.070889 O\n0.384047 0.511711 0.949262 O\n0.628904 0.012072 0.421538 O\n0.128904 0.987928 0.578462 O\n0.884047 0.488289 0.050738 O\n0.044942 0.447520 0.743772 O\n0.959540 0.073176 0.213353 O\n0.459540 0.926824 0.786647 O\n0.544942 0.552480 0.256228 O\n0.488760 0.371041 0.712212 O\n0.469735 0.133356 0.173928 O\n0.969735 0.866644 0.826072 O\n0.988760 0.628959 0.287788 O\n0.743593 0.138478 0.920089 O\n0.260095 0.358695 0.430445 O\n0.760095 0.641305 0.569555 O\n0.243593 0.861522 0.079911 O\n",
            "nsites": 32,
            "nelements": 4,
            "elements": [
                "Ca",
                "Sn",
                "As",
                "O"
            ],
            "chemical_system": "As-Ca-O-Sn",
            "density": 4.456313237613663,
            "density_atomic": 0.06843731205358113,
            "volume": 467.5811927702022,
            "volume_molar": 8.799499248721414,
            "formula_full": "Ca4 Sn4 As4 O20",
            "formula_reduced": "CaSnAsO5",
            "formula_anonymous": "ABCD5",
            "energy": -213.82036637,
            "energy_per_atom": -6.6818864490625,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -200.08036637,
            "band_gap": 1.7467999999999997,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0021497,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:28.723000Z",
            "spacegroup": 4
        }
    ]
}