GET /third-parties/MatprojStructure/?format=api&ordering=-is_theoretical&page=57
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=-is_theoretical&page=58",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-is_theoretical&page=56",
    "results": [
        {
            "id": "mp-1245067",
            "created_at": "2022-09-04T14:40:58.399472Z",
            "structure_string": "Al100\n1.0\n11.949980 0.464068 0.763081\n0.473635 12.322697 -0.289681\n0.787323 -0.292709 12.246149\nAl\n100\ndirect\n0.009674 0.737446 0.304327 Al\n0.357928 0.032694 0.358222 Al\n0.648360 0.408836 0.628776 Al\n0.497407 0.690001 0.921415 Al\n0.812846 0.309185 0.000476 Al\n0.786400 0.858633 0.939195 Al\n0.988085 0.314677 0.306242 Al\n0.313129 0.178240 0.705299 Al\n0.946273 0.525485 0.263969 Al\n0.253047 0.047902 0.172302 Al\n0.371880 0.305206 0.956101 Al\n0.736067 0.621816 0.214009 Al\n0.749032 0.660165 0.646162 Al\n0.105380 0.463619 0.444865 Al\n0.144008 0.010556 0.988270 Al\n0.703417 0.659949 0.000582 Al\n0.184950 0.430053 0.227133 Al\n0.181656 0.213700 0.897314 Al\n0.722954 0.024443 0.189848 Al\n0.128196 0.226234 0.125416 Al\n0.687517 0.689546 0.432719 Al\n0.675857 0.161693 0.782155 Al\n0.150443 0.775188 0.952140 Al\n0.363882 0.375093 0.357535 Al\n0.022055 0.238255 0.500379 Al\n0.678708 0.534884 0.818740 Al\n0.925062 0.960242 0.064773 Al\n0.129938 0.981874 0.361376 Al\n0.803810 0.207402 0.590182 Al\n0.252989 0.412563 0.783776 Al\n0.450755 0.676959 0.479117 Al\n0.417193 0.835166 0.245495 Al\n0.788891 0.205525 0.367390 Al\n0.089516 0.715258 0.728635 Al\n0.391746 0.855797 0.825855 Al\n0.633194 0.830012 0.141533 Al\n0.541950 0.149244 0.975985 Al\n0.605948 0.345867 0.914507 Al\n0.893676 0.510058 0.043122 Al\n0.897981 0.180164 0.153224 Al\n0.195490 0.087579 0.542451 Al\n0.418070 0.438808 0.139019 Al\n0.721707 0.970582 0.648048 Al\n0.093382 0.610273 0.114367 Al\n0.303678 0.793651 0.643877 Al\n0.018123 0.912478 0.845594 Al\n0.295944 0.586567 0.364846 Al\n0.584248 0.325554 0.407112 Al\n0.798221 0.826005 0.277786 Al\n0.036031 0.501029 0.684849 Al\n0.943218 0.032535 0.513325 Al\n0.393900 0.211969 0.492804 Al\n0.102206 0.703461 0.494800 Al\n0.491271 0.646825 0.140707 Al\n0.562300 0.825172 0.601453 Al\n0.519473 0.627654 0.681894 Al\n0.644027 0.465292 0.090034 Al\n0.436552 0.444842 0.572274 Al\n0.278936 0.833849 0.434565 Al\n0.406631 0.989839 0.570337 Al\n0.103142 0.884149 0.162291 Al\n0.627926 0.241542 0.163204 Al\n0.297387 0.643564 0.802527 Al\n0.888632 0.059268 0.746474 Al\n0.310057 0.591358 0.021346 Al\n0.505463 0.033115 0.760555 Al\n0.557625 0.882917 0.386932 Al\n0.335851 0.848548 0.046773 Al\n0.087853 0.902231 0.609184 Al\n0.218496 0.994484 0.755300 Al\n0.059158 0.198757 0.715412 Al\n0.002879 0.369254 0.868479 Al\n0.813505 0.333764 0.775898 Al\n0.630612 0.825446 0.803405 Al\n0.913223 0.735049 0.067724 Al\n0.488439 0.012558 0.137522 Al\n0.591793 0.145800 0.568368 Al\n0.875757 0.638879 0.832361 Al\n0.244757 0.566708 0.594761 Al\n0.158599 0.409976 0.011714 Al\n0.205839 0.220260 0.345692 Al\n0.242451 0.719978 0.216090 Al\n0.484489 0.290898 0.731710 Al\n0.081085 0.574142 0.895269 Al\n0.912399 0.602361 0.476432 Al\n0.732398 0.999722 0.430035 Al\n0.877223 0.824191 0.715763 Al\n0.354643 0.062095 0.946450 Al\n0.742888 0.472646 0.428389 Al\n0.544434 0.522302 0.318808 Al\n0.867075 0.822588 0.494050 Al\n0.973911 0.142772 0.928679 Al\n0.881864 0.415328 0.576680 Al\n0.559440 0.115717 0.340559 Al\n0.759469 0.087402 0.973703 Al\n0.786940 0.382440 0.223069 Al\n0.451993 0.487293 0.842999 Al\n0.926427 0.011578 0.289239 Al\n0.204519 0.335460 0.582679 Al\n0.384841 0.225119 0.172429 Al\n",
            "nsites": 100,
            "nelements": 1,
            "elements": [
                "Al"
            ],
            "chemical_system": "Al",
            "density": 2.5002193184969808,
            "density_atomic": 0.05580361036958565,
            "volume": 1791.9987495021016,
            "volume_molar": 10.791668711245636,
            "formula_full": "Al100",
            "formula_reduced": "Al",
            "formula_anonymous": "A",
            "energy": -363.12671435,
            "energy_per_atom": -3.6312671434999997,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -363.12671435,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:59.476000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-677055",
            "created_at": "2022-09-04T14:40:58.421085Z",
            "structure_string": "Sc8 Cu8 Se16\n1.0\n7.781263 0.000000 0.000000\n0.000000 9.270160 0.000000\n0.000000 8.732288 9.283514\nSc Cu Se\n8 8 16\ndirect\n0.500385 0.994800 0.761122 Sc\n0.742060 0.498907 0.003388 Sc\n0.757940 0.498907 0.503388 Sc\n0.000385 0.005200 0.738878 Sc\n0.999615 0.994800 0.261122 Sc\n0.242060 0.501093 0.496612 Sc\n0.257940 0.501093 0.996612 Sc\n0.499615 0.005200 0.238878 Sc\n0.499226 0.666205 0.107056 Cu\n0.749167 0.165346 0.358575 Cu\n0.999226 0.333795 0.392944 Cu\n0.249167 0.834654 0.141425 Cu\n0.750833 0.165346 0.858575 Cu\n0.000774 0.666205 0.607056 Cu\n0.250833 0.834654 0.641425 Cu\n0.500774 0.333795 0.892944 Cu\n0.494935 0.328712 0.208400 Se\n0.755280 0.830330 0.958223 Se\n0.255280 0.169670 0.541777 Se\n0.001861 0.337963 0.200164 Se\n0.501861 0.662037 0.299836 Se\n0.242062 0.833519 0.951352 Se\n0.742062 0.166481 0.548648 Se\n0.994935 0.671288 0.291600 Se\n0.005065 0.328712 0.708400 Se\n0.257938 0.833519 0.451352 Se\n0.757938 0.166481 0.048648 Se\n0.498139 0.337963 0.700164 Se\n0.998139 0.662037 0.799836 Se\n0.744720 0.830330 0.458223 Se\n0.244720 0.169670 0.041777 Se\n0.505065 0.671288 0.791600 Se\n",
            "nsites": 32,
            "nelements": 3,
            "elements": [
                "Sc",
                "Cu",
                "Se"
            ],
            "chemical_system": "Cu-Sc-Se",
            "density": 5.285174174229198,
            "density_atomic": 0.0477859536258025,
            "volume": 669.6528492573868,
            "volume_molar": 12.602324120509515,
            "formula_full": "Sc8 Cu8 Se16",
            "formula_reduced": "ScCuSe2",
            "formula_anonymous": "ABC2",
            "energy": -182.38218174,
            "energy_per_atom": -5.699443179375,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -174.83018174,
            "band_gap": 0.2884000000000002,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0015178,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:00.589000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-1187237",
            "created_at": "2022-09-04T14:40:58.426814Z",
            "structure_string": "Sr6 Ce2\n1.0\n4.096618 -7.095551 0.000000\n4.096618 7.095551 0.000000\n0.000000 0.000000 6.489148\nSr Ce\n6 2\ndirect\n0.170558 0.341115 0.250000 Sr\n0.658885 0.829442 0.250000 Sr\n0.170558 0.829442 0.250000 Sr\n0.829442 0.658885 0.750000 Sr\n0.341115 0.170558 0.750000 Sr\n0.829442 0.170558 0.750000 Sr\n0.333333 0.666667 0.750000 Ce\n0.666667 0.333333 0.250000 Ce\n",
            "nsites": 8,
            "nelements": 2,
            "elements": [
                "Sr",
                "Ce"
            ],
            "chemical_system": "Ce-Sr",
            "density": 3.547553918679556,
            "density_atomic": 0.021206095707298478,
            "volume": 377.25001859944683,
            "volume_molar": 28.398158921481084,
            "formula_full": "Sr6 Ce2",
            "formula_reduced": "Sr3Ce",
            "formula_anonymous": "AB3",
            "energy": -19.76390854,
            "energy_per_atom": -2.4704885675,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -19.76390854,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 4.7426867,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:11.761000Z",
            "spacegroup": 194
        },
        {
            "id": "mp-1016263",
            "created_at": "2022-09-04T14:40:58.430613Z",
            "structure_string": "Mg3 V1\n1.0\n2.997851 0.000000 0.000000\n0.000000 4.983641 0.000000\n0.000000 0.000000 5.438515\nMg V\n3 1\ndirect\n0.000000 0.000000 0.656526 Mg\n0.000000 0.500000 0.333201 Mg\n0.500000 0.500000 0.852507 Mg\n0.500000 0.000000 0.157765 V\n",
            "nsites": 4,
            "nelements": 2,
            "elements": [
                "Mg",
                "V"
            ],
            "chemical_system": "Mg-V",
            "density": 2.531225146779007,
            "density_atomic": 0.049229210043631566,
            "volume": 81.25257334933514,
            "volume_molar": 12.23286084554802,
            "formula_full": "Mg3 V1",
            "formula_reduced": "Mg3V",
            "formula_anonymous": "AB3",
            "energy": -12.64682298,
            "energy_per_atom": -3.161705745,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -12.64682298,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 2.7693437,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:00.635000Z",
            "spacegroup": 25
        },
        {
            "id": "mp-1517878",
            "created_at": "2022-09-04T14:40:57.445743Z",
            "structure_string": "Na1 La1 Eu1 W1 O6\n1.0\n-0.000000 -4.291247 -4.291247\n4.291247 -0.000000 -4.291247\n4.291247 -4.291247 0.000000\nNa La Eu W O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 La\n0.750000 0.750000 0.750000 Eu\n0.500000 0.500000 0.500000 W\n0.726943 0.273057 0.273057 O\n0.273057 0.726943 0.726943 O\n0.726943 0.273057 0.726943 O\n0.273057 0.726943 0.273057 O\n0.726943 0.726943 0.273057 O\n0.273057 0.273057 0.726943 O\n",
            "nsites": 10,
            "nelements": 5,
            "elements": [
                "Na",
                "La",
                "Eu",
                "W",
                "O"
            ],
            "chemical_system": "Eu-La-Na-O-W",
            "density": 6.237814023073617,
            "density_atomic": 0.06327315144202429,
            "volume": 158.04491750600988,
            "volume_molar": 9.517687396237797,
            "formula_full": "Na1 La1 Eu1 W1 O6",
            "formula_reduced": "NaLaEuWO6",
            "formula_anonymous": "ABCDE6",
            "energy": -86.94236715,
            "energy_per_atom": -8.694236714999999,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -78.38236715,
            "band_gap": 0.6625000000000005,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 6.9999999,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:01.164000Z",
            "spacegroup": 216
        },
        {
            "id": "mp-753293",
            "created_at": "2022-09-04T14:40:56.494653Z",
            "structure_string": "Li4 Ni2 P4 O14\n1.0\n2.788004 7.232635 0.000000\n-2.788004 7.232635 0.000000\n0.000000 3.669732 6.997399\nLi Ni P O\n4 2 4 14\ndirect\n0.935274 0.627942 0.805746 Li\n0.372058 0.064726 0.694254 Li\n0.627942 0.935274 0.305746 Li\n0.064726 0.372058 0.194254 Li\n0.000000 0.000000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.531306 0.245365 0.857934 P\n0.245365 0.531306 0.357934 P\n0.754635 0.468694 0.642066 P\n0.468694 0.754635 0.142066 P\n0.706991 0.059652 0.713687 O\n0.258402 0.351964 0.919830 O\n0.116606 0.664971 0.528110 O\n0.059652 0.706991 0.213687 O\n0.351964 0.258402 0.419830 O\n0.664971 0.116606 0.028110 O\n0.335029 0.883394 0.971890 O\n0.648036 0.741598 0.580170 O\n0.940348 0.293009 0.786313 O\n0.883394 0.335029 0.471890 O\n0.741598 0.648036 0.080170 O\n0.293009 0.940348 0.286313 O\n0.503120 0.496880 0.750000 O\n0.496880 0.503120 0.250000 O\n",
            "nsites": 24,
            "nelements": 4,
            "elements": [
                "Li",
                "Ni",
                "P",
                "O"
            ],
            "chemical_system": "Li-Ni-O-P",
            "density": 2.9011649956591095,
            "density_atomic": 0.0850461515996568,
            "volume": 282.1997180187146,
            "volume_molar": 7.081026768087531,
            "formula_full": "Li4 Ni2 P4 O14",
            "formula_reduced": "Li2NiP2O7",
            "formula_anonymous": "AB2C2D7",
            "energy": -169.09668563,
            "energy_per_atom": -7.0456952345833335,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -154.39668563,
            "band_gap": 2.3814,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 4.0001114,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:00.057000Z",
            "spacegroup": 15
        },
        {
            "id": "mp-1095820",
            "created_at": "2022-09-04T14:40:58.469886Z",
            "structure_string": "In1 Ni2 Au1\n1.0\n-4.891290 5.169100 7.241612\n4.891290 -5.169100 7.241612\n4.891290 5.169100 -7.241612\nIn Ni Au\n1 2 1\ndirect\n0.000000 0.000000 0.000000 In\n0.000000 0.250095 0.250095 Ni\n0.000000 0.749905 0.749905 Ni\n0.000000 0.500000 0.500000 Au\n",
            "nsites": 4,
            "nelements": 3,
            "elements": [
                "In",
                "Ni",
                "Au"
            ],
            "chemical_system": "Au-In-Ni",
            "density": 0.973074852745716,
            "density_atomic": 0.005461681890784344,
            "volume": 732.3751327863523,
            "volume_molar": 110.26165346907763,
            "formula_full": "In1 Ni2 Au1",
            "formula_reduced": "InNi2Au",
            "formula_anonymous": "ABC2",
            "energy": -10.34709663,
            "energy_per_atom": -2.5867741575,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -10.34709663,
            "band_gap": 0.0003000000000001,
            "is_gap_direct": true,
            "is_magnetic": true,
            "total_magnetization": 1.9993842,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:12.539000Z",
            "spacegroup": 71
        },
        {
            "id": "mp-1213572",
            "created_at": "2022-09-04T14:40:58.471886Z",
            "structure_string": "Cs4 W12 Cl28\n1.0\n5.117288 -8.863403 0.000000\n5.117288 8.863403 0.000000\n0.000000 0.000000 15.207642\nCs W Cl\n4 12 28\ndirect\n0.000000 0.000000 0.995488 Cs\n0.000000 0.000000 0.495488 Cs\n0.666667 0.333333 0.710371 Cs\n0.333333 0.666667 0.210371 Cs\n0.486899 0.675542 0.783227 W\n0.188643 0.513101 0.783227 W\n0.811357 0.324458 0.283227 W\n0.324458 0.811357 0.783227 W\n0.675542 0.486899 0.283227 W\n0.513101 0.188643 0.283227 W\n0.476575 0.820557 0.641860 W\n0.343982 0.523425 0.641860 W\n0.656018 0.179443 0.141860 W\n0.179443 0.656018 0.641860 W\n0.820557 0.476575 0.141860 W\n0.523425 0.343982 0.141860 W\n0.628403 0.689023 0.642884 Cl\n0.060621 0.371597 0.642884 Cl\n0.939379 0.310977 0.142884 Cl\n0.310977 0.939379 0.642884 Cl\n0.689023 0.628403 0.142884 Cl\n0.371597 0.060621 0.142884 Cl\n0.987623 0.310634 0.868874 Cl\n0.323012 0.012377 0.868874 Cl\n0.676988 0.689366 0.368874 Cl\n0.689366 0.676988 0.868874 Cl\n0.310634 0.987623 0.368874 Cl\n0.012377 0.323012 0.368874 Cl\n0.666667 0.333333 0.010042 Cl\n0.333333 0.666667 0.510042 Cl\n0.666667 0.333333 0.414202 Cl\n0.333333 0.666667 0.914202 Cl\n0.609393 0.958160 0.781842 Cl\n0.348767 0.390607 0.781842 Cl\n0.651233 0.041840 0.281842 Cl\n0.041840 0.651233 0.781842 Cl\n0.958160 0.609393 0.281842 Cl\n0.390607 0.348767 0.281842 Cl\n0.667431 0.032353 0.555678 Cl\n0.364922 0.332569 0.555678 Cl\n0.635078 0.967647 0.055678 Cl\n0.967647 0.635078 0.555678 Cl\n0.032353 0.667431 0.055678 Cl\n0.332569 0.364922 0.055678 Cl\n",
            "nsites": 44,
            "nelements": 3,
            "elements": [
                "Cs",
                "W",
                "Cl"
            ],
            "chemical_system": "Cl-Cs-W",
            "density": 4.490250974115556,
            "density_atomic": 0.03189484123053989,
            "volume": 1379.5334387138819,
            "volume_molar": 18.881237616049614,
            "formula_full": "Cs4 W12 Cl28",
            "formula_reduced": "CsW3Cl7",
            "formula_anonymous": "AB3C7",
            "energy": -270.8675993,
            "energy_per_atom": -6.156081802272727,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -253.6755993,
            "band_gap": 2.9615,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.000422,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:08.527000Z",
            "spacegroup": 159
        },
        {
            "id": "mp-1100552",
            "created_at": "2022-09-04T14:40:58.501972Z",
            "structure_string": "Li9 Mn7 O16\n1.0\n5.094662 0.000000 0.000000\n-1.727124 5.567366 0.000000\n-1.010392 -0.325631 10.458830\nLi Mn O\n9 7 16\ndirect\n0.992698 0.124440 0.868540 Li\n0.497409 0.752589 0.254353 Li\n0.007302 0.875560 0.131460 Li\n0.500000 0.500000 0.500000 Li\n0.014133 0.626714 0.382323 Li\n0.502591 0.247411 0.745647 Li\n0.985867 0.373286 0.617677 Li\n0.500000 0.000000 0.000000 Li\n0.500000 0.000000 0.500000 Li\n0.993699 0.872861 0.616622 Mn\n0.006301 0.127139 0.383378 Mn\n0.500000 0.500000 0.000000 Mn\n0.490624 0.750227 0.739566 Mn\n0.006654 0.375381 0.128539 Mn\n0.993346 0.624619 0.871461 Mn\n0.509376 0.249773 0.260434 Mn\n0.750056 0.037424 0.689385 O\n0.256184 0.671344 0.065096 O\n0.750952 0.791711 0.939121 O\n0.259576 0.419106 0.320264 O\n0.756203 0.537837 0.189770 O\n0.212716 0.168157 0.550346 O\n0.771340 0.296531 0.434132 O\n0.222446 0.919720 0.794077 O\n0.249048 0.208289 0.060879 O\n0.787284 0.831843 0.449654 O\n0.249944 0.962576 0.310615 O\n0.740424 0.580894 0.679736 O\n0.228660 0.703469 0.565868 O\n0.743816 0.328656 0.934904 O\n0.243797 0.462163 0.810230 O\n0.777554 0.080280 0.205923 O\n",
            "nsites": 32,
            "nelements": 3,
            "elements": [
                "Li",
                "Mn",
                "O"
            ],
            "chemical_system": "Li-Mn-O",
            "density": 3.93524752935637,
            "density_atomic": 0.10787025987709607,
            "volume": 296.652664380894,
            "volume_molar": 5.582762817908693,
            "formula_full": "Li9 Mn7 O16",
            "formula_reduced": "Li9Mn7O16",
            "formula_anonymous": "A7B9C16",
            "energy": -228.87151806,
            "energy_per_atom": -7.152234939375,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -206.20351806,
            "band_gap": 0.6019999999999999,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 25.9988369,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:08.506000Z",
            "spacegroup": 2
        },
        {
            "id": "mp-1224194",
            "created_at": "2022-09-04T14:40:56.851807Z",
            "structure_string": "Ho6 Ga8 Cu4\n1.0\n2.159784 -3.740855 0.000000\n2.159784 3.740855 0.000000\n0.000000 0.000000 21.989102\nHo Ga Cu\n6 8 4\ndirect\n0.000000 0.000000 0.256408 Ho\n0.000000 0.000000 0.589327 Ho\n0.000000 0.000000 0.922016 Ho\n0.000000 0.000000 0.078589 Ho\n0.000000 0.000000 0.412749 Ho\n0.000000 0.000000 0.745357 Ho\n0.333333 0.666667 0.339625 Ga\n0.333333 0.666667 0.672591 Ga\n0.333333 0.666667 0.154612 Ga\n0.333333 0.666667 0.487439 Ga\n0.333333 0.666667 0.819956 Ga\n0.666667 0.333333 0.180751 Ga\n0.666667 0.333333 0.513231 Ga\n0.666667 0.333333 0.845446 Ga\n0.666667 0.333333 0.324989 Cu\n0.666667 0.333333 0.657266 Cu\n0.666667 0.333333 0.992435 Cu\n0.333333 0.666667 0.007214 Cu\n",
            "nsites": 18,
            "nelements": 3,
            "elements": [
                "Ho",
                "Ga",
                "Cu"
            ],
            "chemical_system": "Cu-Ga-Ho",
            "density": 8.419314144753416,
            "density_atomic": 0.050658674403978934,
            "volume": 355.3192066665331,
            "volume_molar": 11.887679318207738,
            "formula_full": "Ho6 Ga8 Cu4",
            "formula_reduced": "Ho3(Ga2Cu)2",
            "formula_anonymous": "A2B3C4",
            "energy": -77.70632112,
            "energy_per_atom": -4.31701784,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -77.70632112,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0047121,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:59.173000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-1048795",
            "created_at": "2022-09-04T14:40:56.852623Z",
            "structure_string": "Mg2 Ta4 O12\n1.0\n5.229550 0.000000 0.000000\n0.000000 5.510996 0.000000\n0.000000 0.000000 7.608652\nMg Ta O\n2 4 12\ndirect\n0.524565 0.321128 0.500000 Mg\n0.024565 0.678872 0.000000 Mg\n0.509504 0.760639 0.748379 Ta\n0.009504 0.239361 0.751621 Ta\n0.009504 0.239361 0.248379 Ta\n0.509504 0.760639 0.251621 Ta\n0.675910 0.068903 0.315259 O\n0.175910 0.931097 0.184741 O\n0.781105 0.529904 0.698953 O\n0.281105 0.470096 0.801047 O\n0.281105 0.470096 0.198953 O\n0.781105 0.529904 0.301047 O\n0.175910 0.931097 0.815259 O\n0.675910 0.068903 0.684741 O\n0.137811 0.226123 0.500000 O\n0.637811 0.773877 0.000000 O\n0.415337 0.709197 0.500000 O\n0.915337 0.290803 0.000000 O\n",
            "nsites": 18,
            "nelements": 3,
            "elements": [
                "Mg",
                "Ta",
                "O"
            ],
            "chemical_system": "Mg-O-Ta",
            "density": 7.303005114456414,
            "density_atomic": 0.08208624104486513,
            "volume": 219.2815722937283,
            "volume_molar": 7.336358302371933,
            "formula_full": "Mg2 Ta4 O12",
            "formula_reduced": "MgTa2O6",
            "formula_anonymous": "AB2C6",
            "energy": -168.86660051,
            "energy_per_atom": -9.381477806111112,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -160.62260051,
            "band_gap": 3.0904,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0003633,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:58.033000Z",
            "spacegroup": 31
        },
        {
            "id": "mp-757057",
            "created_at": "2022-09-04T14:41:00.023273Z",
            "structure_string": "V1 Co3 P4 O16\n1.0\n5.912847 0.000000 0.000000\n0.000000 4.860606 0.000000\n0.000000 0.242220 9.860250\nV Co P O\n1 3 4 16\ndirect\n0.500000 0.976581 0.727670 V\n0.000000 0.030866 0.276296 Co\n0.000000 0.466440 0.768994 Co\n0.500000 0.553628 0.225955 Co\n0.500000 0.092222 0.402447 P\n0.500000 0.392453 0.902814 P\n0.000000 0.584307 0.098347 P\n0.000000 0.927463 0.595514 P\n0.500000 0.151280 0.559894 O\n0.296805 0.245789 0.334753 O\n0.703195 0.245789 0.334753 O\n0.000000 0.236353 0.607857 O\n0.000000 0.270805 0.127153 O\n0.299644 0.241289 0.828794 O\n0.700356 0.241289 0.828794 O\n0.500000 0.343712 0.054692 O\n0.000000 0.649524 0.948117 O\n0.793739 0.726259 0.172591 O\n0.206261 0.726259 0.172591 O\n0.500000 0.704663 0.866609 O\n0.500000 0.780654 0.388240 O\n0.792777 0.780544 0.667169 O\n0.207223 0.780544 0.667169 O\n0.000000 0.851283 0.442786 O\n",
            "nsites": 24,
            "nelements": 4,
            "elements": [
                "V",
                "Co",
                "P",
                "O"
            ],
            "chemical_system": "Co-O-P-V",
            "density": 3.560498776450226,
            "density_atomic": 0.08469080390866027,
            "volume": 283.38377831298186,
            "volume_molar": 7.110737508755884,
            "formula_full": "V1 Co3 P4 O16",
            "formula_reduced": "VCo3(PO4)4",
            "formula_anonymous": "AB3C4D16",
            "energy": -181.52923556,
            "energy_per_atom": -7.563718148333333,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -163.92323556,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 2.4741175,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:57.850000Z",
            "spacegroup": 6
        }
    ]
}