GET /third-parties/MatprojStructure/?format=api&ordering=-decomposes_to&page=12116
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=-decomposes_to&page=12117",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-decomposes_to&page=12115",
    "results": [
        {
            "id": "mp-13192",
            "created_at": "2022-09-04T14:44:50.847769Z",
            "structure_string": "In6 Re1 O12\n1.0\n4.112121 -4.832436 0.000000\n4.112121 4.832436 0.000000\n-1.566807 0.000000 6.148747\nIn Re O\n6 1 12\ndirect\n0.677226 0.860231 0.396895 In\n0.396895 0.677226 0.860231 In\n0.860231 0.396895 0.677226 In\n0.322774 0.139769 0.603105 In\n0.603105 0.322774 0.139769 In\n0.139769 0.603105 0.322774 In\n0.000000 0.000000 0.000000 Re\n0.414081 0.594032 0.175982 O\n0.175982 0.414081 0.594032 O\n0.594032 0.175982 0.414081 O\n0.585919 0.405968 0.824018 O\n0.824018 0.585919 0.405968 O\n0.405968 0.824018 0.585919 O\n0.896808 0.045075 0.708276 O\n0.954925 0.291724 0.103192 O\n0.291724 0.103192 0.954925 O\n0.103192 0.954925 0.291724 O\n0.045075 0.708276 0.896808 O\n0.708276 0.896808 0.045075 O\n",
            "nsites": 19,
            "nelements": 3,
            "elements": [
                "In",
                "Re",
                "O"
            ],
            "chemical_system": "In-O-Re",
            "density": 7.251181504819551,
            "density_atomic": 0.07775082129050398,
            "volume": 244.3704090148376,
            "volume_molar": 7.745436845611184,
            "formula_full": "In6 Re1 O12",
            "formula_reduced": "In6ReO12",
            "formula_anonymous": "AB6C12",
            "energy": -125.60349351,
            "energy_per_atom": -6.610710184736843,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -117.35949351,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 0.990919,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:43.024000Z",
            "spacegroup": 148
        },
        {
            "id": "mp-1190450",
            "created_at": "2022-09-04T14:44:50.909460Z",
            "structure_string": "Na2 Nb2 Se4 O14\n1.0\n3.934146 -5.653850 0.000000\n3.934146 5.653850 0.000000\n0.000000 0.000000 7.516351\nNa Nb Se O\n2 2 4 14\ndirect\n0.979966 0.979966 0.364591 Na\n0.020034 0.020034 0.864591 Na\n0.511875 0.511875 0.900390 Nb\n0.488125 0.488125 0.400390 Nb\n0.564680 0.965813 0.626243 Se\n0.965813 0.564680 0.626243 Se\n0.435320 0.034187 0.126243 Se\n0.034187 0.435320 0.126243 Se\n0.546585 0.798941 0.810359 O\n0.798941 0.546585 0.810359 O\n0.453415 0.201059 0.310359 O\n0.201059 0.453415 0.310359 O\n0.543742 0.793758 0.444468 O\n0.793758 0.543742 0.444468 O\n0.456258 0.206242 0.944468 O\n0.206242 0.456258 0.944468 O\n0.819205 0.098515 0.622208 O\n0.098515 0.819205 0.622208 O\n0.180795 0.901485 0.122208 O\n0.901485 0.180795 0.122208 O\n0.412870 0.412870 0.631402 O\n0.587130 0.587130 0.131402 O\n",
            "nsites": 22,
            "nelements": 4,
            "elements": [
                "Na",
                "Nb",
                "Se",
                "O"
            ],
            "chemical_system": "Na-Nb-O-Se",
            "density": 3.831977619992375,
            "density_atomic": 0.06579469488849357,
            "volume": 334.37346335118343,
            "volume_molar": 9.152927557770582,
            "formula_full": "Na2 Nb2 Se4 O14",
            "formula_reduced": "NaNbSe2O7",
            "formula_anonymous": "ABC2D7",
            "energy": -149.6780169,
            "energy_per_atom": -6.803546222727272,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -140.0600169,
            "band_gap": 2.9067000000000003,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0003518,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:42.897000Z",
            "spacegroup": 36
        },
        {
            "id": "mp-697749",
            "created_at": "2022-09-04T14:44:50.912063Z",
            "structure_string": "Li2 V4 P6 O24\n1.0\n4.285159 7.439582 0.000000\n-4.285159 7.439582 0.000000\n0.000000 4.812400 7.128324\nLi V P O\n2 4 6 24\ndirect\n0.032936 0.354651 0.945335 Li\n0.354651 0.032936 0.445335 Li\n0.361890 0.850561 0.921365 V\n0.850561 0.361890 0.421365 V\n0.645015 0.149628 0.071927 V\n0.149628 0.645015 0.571927 V\n0.473679 0.247946 0.741534 P\n0.527699 0.751868 0.258450 P\n0.964493 0.037479 0.244751 P\n0.037479 0.964493 0.744751 P\n0.751868 0.527699 0.758450 P\n0.247946 0.473679 0.241534 P\n0.774979 0.058857 0.241832 O\n0.285245 0.627934 0.050456 O\n0.275498 0.406636 0.746306 O\n0.236649 0.525525 0.397801 O\n0.761091 0.479864 0.604465 O\n0.451485 0.063725 0.785921 O\n0.479864 0.761091 0.104465 O\n0.542959 0.938086 0.224893 O\n0.004338 0.125071 0.559713 O\n0.938086 0.542959 0.724893 O\n0.878398 0.000868 0.921223 O\n0.525525 0.236649 0.897801 O\n0.719758 0.586469 0.266166 O\n0.125071 0.004338 0.059713 O\n0.950929 0.231663 0.231395 O\n0.000868 0.878398 0.421223 O\n0.586469 0.719758 0.766166 O\n0.058857 0.774979 0.741832 O\n0.063725 0.451485 0.285921 O\n0.371865 0.721692 0.450380 O\n0.721692 0.371865 0.950380 O\n0.406636 0.275498 0.246306 O\n0.627934 0.285245 0.550456 O\n0.231663 0.950929 0.731395 O\n",
            "nsites": 36,
            "nelements": 4,
            "elements": [
                "Li",
                "V",
                "P",
                "O"
            ],
            "chemical_system": "Li-O-P-V",
            "density": 2.8770911166229305,
            "density_atomic": 0.07920810038515197,
            "volume": 454.4989694860605,
            "volume_molar": 7.602935470888892,
            "formula_full": "Li2 V4 P6 O24",
            "formula_reduced": "LiV2(PO4)3",
            "formula_anonymous": "AB2C3D12",
            "energy": -286.55394611,
            "energy_per_atom": -7.95983183638889,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -263.26594611,
            "band_gap": 1.0983,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 4.0001634,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:43.119000Z",
            "spacegroup": 9
        },
        {
            "id": "mp-999132",
            "created_at": "2022-09-04T14:44:50.913075Z",
            "structure_string": "Sm1 Tl1 Te2\n1.0\n8.322239 -2.265825 0.000000\n8.322239 2.265825 0.000000\n7.705342 0.000000 3.875735\nSm Tl Te\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.500000 0.500000 0.500000 Tl\n0.738836 0.738836 0.738836 Te\n0.261164 0.261164 0.261164 Te\n",
            "nsites": 4,
            "nelements": 3,
            "elements": [
                "Sm",
                "Tl",
                "Te"
            ],
            "chemical_system": "Sm-Te-Tl",
            "density": 6.929277338212523,
            "density_atomic": 0.027365877130031347,
            "volume": 146.16743256551405,
            "volume_molar": 22.006021335933337,
            "formula_full": "Sm1 Tl1 Te2",
            "formula_reduced": "SmTlTe2",
            "formula_anonymous": "ABC2",
            "energy": -18.48663329,
            "energy_per_atom": -4.6216583225,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -17.64263329,
            "band_gap": 0.8317999999999994,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0008163,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:45.046000Z",
            "spacegroup": 166
        },
        {
            "id": "mp-21916",
            "created_at": "2022-09-04T14:44:50.913167Z",
            "structure_string": "Sm6 Ni24 P12\n1.0\n3.730114 0.000000 0.000000\n0.000000 10.700365 0.000000\n0.000000 0.000000 14.106246\nSm Ni P\n6 24 12\ndirect\n0.000000 0.879314 0.276976 Sm\n0.000000 0.120686 0.723024 Sm\n0.000000 0.000000 0.000000 Sm\n0.500000 0.620686 0.776976 Sm\n0.500000 0.379314 0.223024 Sm\n0.500000 0.500000 0.500000 Sm\n0.500000 0.247605 0.413040 Ni\n0.000000 0.597632 0.940733 Ni\n0.000000 0.927018 0.563767 Ni\n0.500000 0.320325 0.784389 Ni\n0.500000 0.069429 0.177942 Ni\n0.000000 0.072982 0.436233 Ni\n0.500000 0.930571 0.822058 Ni\n0.000000 0.402368 0.059267 Ni\n0.000000 0.430571 0.677942 Ni\n0.500000 0.774874 0.962537 Ni\n0.000000 0.820325 0.715611 Ni\n0.500000 0.752395 0.586960 Ni\n0.000000 0.274874 0.537463 Ni\n0.500000 0.572982 0.063767 Ni\n0.000000 0.569429 0.322058 Ni\n0.000000 0.252395 0.913040 Ni\n0.500000 0.097632 0.559267 Ni\n0.000000 0.179675 0.284389 Ni\n0.500000 0.679675 0.215611 Ni\n0.500000 0.427018 0.936233 Ni\n0.000000 0.747605 0.086960 Ni\n0.500000 0.225126 0.037463 Ni\n0.000000 0.725126 0.462537 Ni\n0.500000 0.902368 0.440733 Ni\n0.000000 0.206891 0.128385 P\n0.000000 0.638913 0.617796 P\n0.000000 0.361087 0.382204 P\n0.500000 0.138913 0.882204 P\n0.000000 0.433021 0.841218 P\n0.500000 0.293109 0.628385 P\n0.500000 0.861087 0.117796 P\n0.000000 0.793109 0.871615 P\n0.500000 0.706891 0.371615 P\n0.500000 0.066979 0.341218 P\n0.000000 0.566979 0.158782 P\n0.500000 0.933021 0.658782 P\n",
            "nsites": 42,
            "nelements": 3,
            "elements": [
                "Sm",
                "Ni",
                "P"
            ],
            "chemical_system": "Ni-P-Sm",
            "density": 7.911421652616067,
            "density_atomic": 0.0745962747784478,
            "volume": 563.0307964404484,
            "volume_molar": 8.072977877093543,
            "formula_full": "Sm6 Ni24 P12",
            "formula_reduced": "Sm(Ni2P)2",
            "formula_anonymous": "AB2C4",
            "energy": -265.60309081,
            "energy_per_atom": -6.32388311452381,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -265.60309081,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0044728,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:43.629000Z",
            "spacegroup": 58
        },
        {
            "id": "mp-565593",
            "created_at": "2022-09-04T14:44:50.915487Z",
            "structure_string": "Na12 Nb4 As8 O36\n1.0\n9.532685 0.000000 0.000000\n0.000000 10.489932 0.000000\n0.000000 6.421034 10.662185\nNa Nb As O\n12 4 8 36\ndirect\n0.936374 0.200263 0.148107 Na\n0.278234 0.471109 0.854976 Na\n0.221766 0.471109 0.354976 Na\n0.721766 0.528891 0.145024 Na\n0.436374 0.799737 0.351893 Na\n0.778234 0.528891 0.645024 Na\n0.133180 0.135975 0.847768 Na\n0.866820 0.864025 0.152232 Na\n0.633180 0.864025 0.652232 Na\n0.063626 0.799737 0.851893 Na\n0.563626 0.200263 0.648107 Na\n0.366820 0.135975 0.347768 Na\n0.393510 0.732456 0.969147 Nb\n0.893510 0.267544 0.530853 Nb\n0.606490 0.267544 0.030853 Nb\n0.106490 0.732456 0.469147 Nb\n0.828997 0.882043 0.388860 As\n0.282426 0.827958 0.610777 As\n0.171003 0.117957 0.611140 As\n0.217574 0.827958 0.110777 As\n0.671003 0.882043 0.888860 As\n0.717574 0.172042 0.389223 As\n0.782426 0.172042 0.889223 As\n0.328997 0.117957 0.111140 As\n0.425079 0.303395 0.414351 O\n0.519775 0.554019 0.016523 O\n0.599212 0.769199 0.040075 O\n0.925079 0.696605 0.085649 O\n0.074921 0.303395 0.914351 O\n0.415161 0.163779 0.519999 O\n0.400788 0.230801 0.959925 O\n0.574921 0.696605 0.585649 O\n0.252271 0.905677 0.944628 O\n0.084839 0.163779 0.019999 O\n0.180223 0.664177 0.648064 O\n0.480225 0.445981 0.983477 O\n0.584839 0.836221 0.480001 O\n0.270412 0.661284 0.901123 O\n0.355927 0.926429 0.144227 O\n0.247729 0.905677 0.444628 O\n0.915161 0.836221 0.980001 O\n0.729588 0.338716 0.098877 O\n0.819777 0.335823 0.351936 O\n0.644073 0.073571 0.855773 O\n0.747729 0.094323 0.055372 O\n0.900788 0.769199 0.540075 O\n0.099212 0.230801 0.459925 O\n0.319777 0.664177 0.148064 O\n0.680223 0.335823 0.851936 O\n0.497781 0.117652 0.187163 O\n0.502219 0.882348 0.812837 O\n0.980225 0.554019 0.516523 O\n0.752271 0.094323 0.555372 O\n0.229588 0.661284 0.401123 O\n0.002219 0.117652 0.687163 O\n0.144073 0.926429 0.644227 O\n0.855927 0.073571 0.355773 O\n0.997781 0.882348 0.312837 O\n0.770412 0.338716 0.598877 O\n0.019775 0.445981 0.483477 O\n",
            "nsites": 60,
            "nelements": 4,
            "elements": [
                "Na",
                "Nb",
                "As",
                "O"
            ],
            "chemical_system": "As-Na-Nb-O",
            "density": 2.839009478389891,
            "density_atomic": 0.056275209621672824,
            "volume": 1066.188831696376,
            "volume_molar": 10.70123203535921,
            "formula_full": "Na12 Nb4 As8 O36",
            "formula_reduced": "Na3NbAs2O9",
            "formula_anonymous": "AB2C3D9",
            "energy": -365.22196002,
            "energy_per_atom": -6.087032667,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -359.42596002,
            "band_gap": 2.0426,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 4.0011021,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:43.681000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-755702",
            "created_at": "2022-09-04T14:44:50.848357Z",
            "structure_string": "Li4 Ti2 V2 O8\n1.0\n2.073293 4.741434 -0.000116\n-0.000134 -0.000084 5.842018\n5.170609 -0.210881 -0.000116\nLi Ti V O\n4 2 2 8\ndirect\n0.500000 0.250008 0.000000 Li\n0.000000 0.749993 0.500000 Li\n0.500000 0.000000 0.500000 Li\n0.000000 0.500000 0.000000 Li\n0.000000 0.249740 0.500001 Ti\n0.500000 0.750261 0.000000 Ti\n0.499995 0.499999 0.500005 V\n0.999995 0.000000 0.000006 V\n0.765922 0.250436 0.266776 O\n0.266767 0.749567 0.765930 O\n0.234069 0.250432 0.733233 O\n0.733223 0.749564 0.234079 O\n0.248597 0.000006 0.248581 O\n0.748492 0.500004 0.748474 O\n0.251524 0.499995 0.251510 O\n0.751418 0.999995 0.751404 O\n",
            "nsites": 16,
            "nelements": 4,
            "elements": [
                "Li",
                "Ti",
                "V",
                "O"
            ],
            "chemical_system": "Li-O-Ti-V",
            "density": 4.025271492016532,
            "density_atomic": 0.10975612519695829,
            "volume": 145.77774107174307,
            "volume_molar": 5.486837977555437,
            "formula_full": "Li4 Ti2 V2 O8",
            "formula_reduced": "Li2TiVO4",
            "formula_anonymous": "ABC2D4",
            "energy": -124.98785996,
            "energy_per_atom": -7.8117412475,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -116.09185996,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 0.0448247,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:41.639000Z",
            "spacegroup": 119
        },
        {
            "id": "mp-18479",
            "created_at": "2022-09-04T14:44:50.856641Z",
            "structure_string": "Nd8 W4 O24\n1.0\n5.877156 8.564767 0.000000\n-5.877156 8.564767 0.000000\n0.000000 1.791318 5.416134\nNd W O\n8 4 24\ndirect\n0.108292 0.891708 0.750000 Nd\n0.891708 0.108292 0.250000 Nd\n0.063589 0.290902 0.617809 Nd\n0.709098 0.936411 0.882191 Nd\n0.936411 0.709098 0.382191 Nd\n0.290902 0.063589 0.117809 Nd\n0.629820 0.370180 0.750000 Nd\n0.370180 0.629820 0.250000 Nd\n0.502686 0.797994 0.555957 W\n0.202006 0.497314 0.944043 W\n0.497314 0.202006 0.444043 W\n0.797994 0.502686 0.055957 W\n0.612483 0.176049 0.141474 O\n0.823951 0.387517 0.358526 O\n0.387517 0.823951 0.858526 O\n0.176049 0.612483 0.641474 O\n0.474403 0.069523 0.731764 O\n0.930477 0.525597 0.768236 O\n0.525597 0.930477 0.268236 O\n0.069523 0.474403 0.231764 O\n0.328589 0.215127 0.373703 O\n0.784873 0.671411 0.126297 O\n0.671411 0.784873 0.626297 O\n0.215127 0.328589 0.873703 O\n0.891084 0.921898 0.073144 O\n0.078102 0.108916 0.426856 O\n0.108916 0.078102 0.926856 O\n0.921898 0.891084 0.573144 O\n0.163064 0.680798 0.078929 O\n0.319202 0.836936 0.421071 O\n0.836936 0.319202 0.921071 O\n0.680798 0.163064 0.578929 O\n0.382297 0.457773 0.982797 O\n0.542227 0.617703 0.517203 O\n0.617703 0.542227 0.017203 O\n0.457773 0.382297 0.482797 O\n",
            "nsites": 36,
            "nelements": 3,
            "elements": [
                "Nd",
                "W",
                "O"
            ],
            "chemical_system": "Nd-O-W",
            "density": 6.923093016047652,
            "density_atomic": 0.06602377213004801,
            "volume": 545.2581523074789,
            "volume_molar": 9.121170399258768,
            "formula_full": "Nd8 W4 O24",
            "formula_reduced": "Nd2WO6",
            "formula_anonymous": "AB2C6",
            "energy": -323.31339493,
            "energy_per_atom": -8.980927636944445,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -289.07339492999995,
            "band_gap": 3.1133,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0006313,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:43.834000Z",
            "spacegroup": 15
        },
        {
            "id": "mp-3707",
            "created_at": "2022-09-04T14:44:50.897814Z",
            "structure_string": "Ca2 Ge4 O10\n1.0\n4.450949 3.334636 0.000000\n-4.450949 3.334636 0.000000\n0.000000 2.793317 6.402203\nCa Ge O\n2 4 10\ndirect\n0.328518 0.671482 0.750000 Ca\n0.671482 0.328518 0.250000 Ca\n0.315446 0.684554 0.250000 Ge\n0.684554 0.315446 0.750000 Ge\n0.000000 0.000000 0.000000 Ge\n0.000000 0.000000 0.500000 Ge\n0.901942 0.308159 0.898561 O\n0.691841 0.098058 0.601439 O\n0.098058 0.691841 0.101439 O\n0.308159 0.901942 0.398561 O\n0.634324 0.750881 0.074813 O\n0.249119 0.365676 0.425187 O\n0.070104 0.929896 0.750000 O\n0.929896 0.070104 0.250000 O\n0.750881 0.634324 0.574813 O\n0.365676 0.249119 0.925187 O\n",
            "nsites": 16,
            "nelements": 3,
            "elements": [
                "Ca",
                "Ge",
                "O"
            ],
            "chemical_system": "Ca-Ge-O",
            "density": 4.637093786843162,
            "density_atomic": 0.0841898031281606,
            "volume": 190.04676820117388,
            "volume_molar": 7.153052431816008,
            "formula_full": "Ca2 Ge4 O10",
            "formula_reduced": "CaGe2O5",
            "formula_anonymous": "AB2C5",
            "energy": -112.09961971,
            "energy_per_atom": -7.006226231875,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -105.22961971,
            "band_gap": 2.4523,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 7e-07,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:40.878000Z",
            "spacegroup": 15
        },
        {
            "id": "mp-775272",
            "created_at": "2022-09-04T14:44:50.898788Z",
            "structure_string": "Ti1 Fe3 P6 O24\n1.0\n7.796759 -4.370601 0.000000\n7.796759 4.370601 0.000000\n5.346747 0.000000 7.162674\nTi Fe P O\n1 3 6 24\ndirect\n0.140130 0.140130 0.140130 Ti\n0.856976 0.856976 0.856976 Fe\n0.641902 0.641902 0.641902 Fe\n0.357430 0.357430 0.357430 Fe\n0.249222 0.534201 0.966434 P\n0.966434 0.249222 0.534201 P\n0.534201 0.966434 0.249222 P\n0.467655 0.034477 0.747496 P\n0.034477 0.747496 0.467655 P\n0.747496 0.467655 0.034477 P\n0.727839 0.489026 0.863055 O\n0.489026 0.863055 0.727839 O\n0.079067 0.711300 0.937469 O\n0.863055 0.727839 0.489026 O\n0.422654 0.552872 0.790656 O\n0.213037 0.363174 0.006330 O\n0.937469 0.079067 0.711300 O\n0.790656 0.422654 0.552872 O\n0.552872 0.790656 0.422654 O\n0.638962 0.007419 0.771625 O\n0.292049 0.069389 0.920959 O\n0.007419 0.771625 0.638962 O\n0.006330 0.213037 0.363174 O\n0.711300 0.937469 0.079067 O\n0.363174 0.006330 0.213037 O\n0.442438 0.209092 0.575542 O\n0.209092 0.575542 0.442438 O\n0.069389 0.920959 0.292049 O\n0.771625 0.638962 0.007419 O\n0.575542 0.442438 0.209092 O\n0.136700 0.274667 0.508757 O\n0.920959 0.292049 0.069389 O\n0.508757 0.136700 0.274667 O\n0.274667 0.508757 0.136700 O\n",
            "nsites": 34,
            "nelements": 4,
            "elements": [
                "Ti",
                "Fe",
                "P",
                "O"
            ],
            "chemical_system": "Fe-O-P-Ti",
            "density": 2.6710721812841323,
            "density_atomic": 0.06964957409795657,
            "volume": 488.158046051821,
            "volume_molar": 8.646342548384201,
            "formula_full": "Ti1 Fe3 P6 O24",
            "formula_reduced": "TiFe3(PO4)6",
            "formula_anonymous": "AB3C6D24",
            "energy": -262.78510574,
            "energy_per_atom": -7.728973698235294,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -239.52910574,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 20.0000001,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:41.920000Z",
            "spacegroup": 146
        },
        {
            "id": "mp-1228450",
            "created_at": "2022-09-04T14:44:51.022770Z",
            "structure_string": "Ba4 Bi1 Pb3 O12\n1.0\n6.156243 0.000000 0.000000\n0.000000 6.223880 0.000000\n0.000000 0.003494 8.712924\nBa Bi Pb O\n4 1 3 12\ndirect\n0.000000 0.504773 0.752545 Ba\n0.500000 0.006160 0.247184 Ba\n0.500000 0.993840 0.752816 Ba\n0.000000 0.495227 0.247455 Ba\n0.500000 0.500000 0.500000 Bi\n0.000000 0.000000 0.500000 Pb\n0.500000 0.500000 0.000000 Pb\n0.000000 0.000000 0.000000 Pb\n0.000000 0.065423 0.751645 O\n0.500000 0.565475 0.251009 O\n0.500000 0.434525 0.748991 O\n0.000000 0.934577 0.248355 O\n0.251393 0.252444 0.464722 O\n0.749367 0.749440 0.962205 O\n0.251393 0.747556 0.535278 O\n0.749367 0.250560 0.037795 O\n0.250633 0.749440 0.962205 O\n0.748607 0.252444 0.464722 O\n0.250633 0.250560 0.037795 O\n0.748607 0.747556 0.535278 O\n",
            "nsites": 20,
            "nelements": 4,
            "elements": [
                "Ba",
                "Bi",
                "Pb",
                "O"
            ],
            "chemical_system": "Ba-Bi-O-Pb",
            "density": 7.818580764753582,
            "density_atomic": 0.059908590961003864,
            "volume": 333.84193617604103,
            "volume_molar": 10.052215656215278,
            "formula_full": "Ba4 Bi1 Pb3 O12",
            "formula_reduced": "Ba4Bi(PbO4)3",
            "formula_anonymous": "AB3C4D12",
            "energy": -125.09980039,
            "energy_per_atom": -6.2549900195,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -116.85580039,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0003699,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:48.964000Z",
            "spacegroup": 10
        },
        {
            "id": "mp-1190071",
            "created_at": "2022-09-04T14:44:51.240293Z",
            "structure_string": "Er12 Ga2 Co4\n1.0\n-4.609500 -4.710532 4.931822\n-4.609500 4.710532 -4.931822\n4.609500 -4.710532 -4.931822\nEr Ga Co\n12 2 4\ndirect\n0.700369 0.267199 0.967568 Er\n0.299631 0.732801 0.032432 Er\n0.700369 0.732801 0.433171 Er\n0.299631 0.267199 0.566829 Er\n0.804260 0.123093 0.318833 Er\n0.804260 0.485427 0.681167 Er\n0.195740 0.876907 0.681167 Er\n0.195740 0.514573 0.318833 Er\n0.599853 0.783140 0.816713 Er\n0.966426 0.783140 0.183287 Er\n0.033574 0.216860 0.816713 Er\n0.400147 0.216860 0.183287 Er\n0.500000 0.500000 0.000000 Ga\n0.500000 0.000000 0.500000 Ga\n0.874685 0.500000 0.374685 Co\n0.125315 0.500000 0.625315 Co\n0.000000 0.113782 0.113782 Co\n0.000000 0.886218 0.886218 Co\n",
            "nsites": 18,
            "nelements": 3,
            "elements": [
                "Er",
                "Ga",
                "Co"
            ],
            "chemical_system": "Co-Er-Ga",
            "density": 9.235320581984638,
            "density_atomic": 0.04202244741910612,
            "volume": 428.34249563046717,
            "volume_molar": 14.330771123201991,
            "formula_full": "Er12 Ga2 Co4",
            "formula_reduced": "Er6GaCo2",
            "formula_anonymous": "AB2C6",
            "energy": -94.80475706,
            "energy_per_atom": -5.2669309477777775,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -94.80475706,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0007224,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:40.403000Z",
            "spacegroup": 71
        }
    ]
}