GET /third-parties/MatprojStructure/?format=api&ordering=formula_full&page=10198
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=formula_full&page=10199",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=formula_full&page=10197",
    "results": [
        {
            "id": "mp-17551",
            "created_at": "2022-09-04T14:41:17.662871Z",
            "structure_string": "Sr4 Ni4 P8 O28\n1.0\n8.335592 0.000000 0.000000\n0.000000 5.330772 0.000000\n0.000000 0.028282 12.795072\nSr Ni P O\n4 4 8 28\ndirect\n0.158651 0.214732 0.781625 Sr\n0.658651 0.285268 0.718375 Sr\n0.841349 0.785268 0.218375 Sr\n0.341349 0.714732 0.281625 Sr\n0.351069 0.686985 0.612541 Ni\n0.851069 0.813015 0.887459 Ni\n0.648931 0.313015 0.387459 Ni\n0.148931 0.186985 0.112541 Ni\n0.303571 0.191641 0.482457 P\n0.803571 0.308359 0.017543 P\n0.696429 0.808359 0.517543 P\n0.196429 0.691641 0.982457 P\n0.962960 0.747081 0.664234 P\n0.462960 0.752919 0.835766 P\n0.037040 0.252919 0.335766 P\n0.537040 0.247081 0.164234 P\n0.317205 0.309788 0.591545 O\n0.817205 0.190212 0.908455 O\n0.682795 0.690212 0.408455 O\n0.182795 0.809788 0.091545 O\n0.166022 0.407186 0.979053 O\n0.666022 0.092814 0.520947 O\n0.833978 0.592814 0.020947 O\n0.333978 0.907186 0.479053 O\n0.438638 0.018309 0.794516 O\n0.938638 0.481691 0.705484 O\n0.561362 0.981691 0.205484 O\n0.061362 0.518309 0.294516 O\n0.383463 0.736671 0.950738 O\n0.883463 0.763329 0.549262 O\n0.616537 0.263329 0.049262 O\n0.116537 0.236671 0.450738 O\n0.361747 0.325133 0.151988 O\n0.861747 0.174867 0.348012 O\n0.638253 0.674867 0.848012 O\n0.138253 0.825133 0.651988 O\n0.403932 0.331377 0.399359 O\n0.903932 0.168623 0.100641 O\n0.596068 0.668623 0.600641 O\n0.096068 0.831377 0.899359 O\n0.122008 0.056411 0.266110 O\n0.622008 0.443589 0.233890 O\n0.877992 0.943589 0.733890 O\n0.377992 0.556411 0.766110 O\n",
            "nsites": 44,
            "nelements": 4,
            "elements": [
                "Sr",
                "Ni",
                "P",
                "O"
            ],
            "chemical_system": "Ni-O-P-Sr",
            "density": 3.7414337061406857,
            "density_atomic": 0.07738973959345029,
            "volume": 568.5508212218334,
            "volume_molar": 7.7815751695715365,
            "formula_full": "Sr4 Ni4 P8 O28",
            "formula_reduced": "SrNiP2O7",
            "formula_anonymous": "ABC2D7",
            "energy": -332.56647765,
            "energy_per_atom": -7.558329037500001,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -303.16647765,
            "band_gap": 3.2356,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 7.9998507,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:18.243000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-1238027",
            "created_at": "2022-09-04T14:41:09.045008Z",
            "structure_string": "Sr4 Ni8 B8\n1.0\n3.249728 0.000000 0.000000\n0.000000 6.281790 0.000000\n0.000000 0.000000 13.384795\nSr Ni B\n4 8 8\ndirect\n0.500000 0.641377 0.398269 Sr\n0.500000 0.358623 0.601731 Sr\n0.000000 0.858623 0.898269 Sr\n0.000000 0.141377 0.101731 Sr\n0.500000 0.694276 0.130389 Ni\n0.500000 0.305724 0.869611 Ni\n0.000000 0.805724 0.630389 Ni\n0.000000 0.194276 0.369611 Ni\n0.500000 0.623781 0.758292 Ni\n0.500000 0.376219 0.241708 Ni\n0.000000 0.876219 0.258292 Ni\n0.000000 0.123781 0.741708 Ni\n0.500000 0.072085 0.446091 B\n0.500000 0.927915 0.553909 B\n0.000000 0.427915 0.946091 B\n0.000000 0.572085 0.053909 B\n0.500000 0.060595 0.309864 B\n0.500000 0.939405 0.690136 B\n0.000000 0.439405 0.809864 B\n0.000000 0.560595 0.190136 B\n",
            "nsites": 20,
            "nelements": 3,
            "elements": [
                "Sr",
                "Ni",
                "B"
            ],
            "chemical_system": "B-Ni-Sr",
            "density": 5.509117532858179,
            "density_atomic": 0.0731960837672022,
            "volume": 273.2386621066963,
            "volume_molar": 8.227408421403016,
            "formula_full": "Sr4 Ni8 B8",
            "formula_reduced": "Sr(NiB)2",
            "formula_anonymous": "AB2C2",
            "energy": -105.79906412,
            "energy_per_atom": -5.289953206,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -105.79906412,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.1227883,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:14.715000Z",
            "spacegroup": 58
        },
        {
            "id": "mp-1189312",
            "created_at": "2022-09-04T14:41:06.439808Z",
            "structure_string": "Sr4 Ni8 B8\n1.0\n0.015521 0.003632 -3.211585\n0.540672 -7.692848 0.009389\n-11.102642 0.889334 0.015590\nSr Ni B\n4 8 8\ndirect\n0.504222 0.665903 0.430553 Sr\n0.497547 0.333220 0.569270 Sr\n0.001143 0.817697 0.917314 Sr\n0.998444 0.182649 0.082976 Sr\n0.497200 0.811599 0.156269 Ni\n0.502467 0.190570 0.844397 Ni\n0.998552 0.715160 0.679472 Ni\n0.002558 0.283815 0.320473 Ni\n0.500751 0.498971 0.810998 Ni\n0.499065 0.502299 0.188419 Ni\n0.998809 0.951367 0.305996 Ni\n0.000532 0.048053 0.694506 Ni\n0.499893 0.007966 0.428568 B\n0.498380 0.991080 0.571570 B\n0.996848 0.452468 0.927114 B\n0.003265 0.547961 0.072431 B\n0.501199 0.121354 0.307762 B\n0.499094 0.877226 0.692143 B\n0.000917 0.310167 0.791940 B\n0.999115 0.690475 0.207827 B\n",
            "nsites": 20,
            "nelements": 3,
            "elements": [
                "Sr",
                "Ni",
                "B"
            ],
            "chemical_system": "B-Ni-Sr",
            "density": 5.518829245210815,
            "density_atomic": 0.07332511701193635,
            "volume": 272.7578327184158,
            "volume_molar": 8.212930310114167,
            "formula_full": "Sr4 Ni8 B8",
            "formula_reduced": "Sr(NiB)2",
            "formula_anonymous": "AB2C2",
            "energy": -104.22237336,
            "energy_per_atom": -5.211118668,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -104.22237336,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0001648,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:24.994000Z",
            "spacegroup": 10
        },
        {
            "id": "mp-646605",
            "created_at": "2022-09-04T14:46:38.195098Z",
            "structure_string": "Sr4 Ni8 Te12 Cl8 O32\n1.0\n9.008914 0.000000 0.000000\n0.000000 6.736471 0.000000\n0.000000 6.050499 18.477727\nSr Ni Te Cl O\n4 8 12 8 32\ndirect\n0.411650 0.016916 0.723433 Sr\n0.588350 0.983084 0.276567 Sr\n0.911650 0.983084 0.776567 Sr\n0.088350 0.016916 0.223433 Sr\n0.251655 0.577234 0.319848 Ni\n0.751654 0.422766 0.180152 Ni\n0.959348 0.315528 0.319886 Ni\n0.040652 0.684472 0.680114 Ni\n0.748345 0.422766 0.680152 Ni\n0.248345 0.577234 0.819848 Ni\n0.459348 0.684472 0.180114 Ni\n0.540652 0.315528 0.819886 Ni\n0.394159 0.595242 0.635096 Te\n0.074427 0.291774 0.607462 Te\n0.425573 0.291774 0.107462 Te\n0.776166 0.957357 0.112231 Te\n0.925573 0.708226 0.392538 Te\n0.276166 0.042643 0.387769 Te\n0.605841 0.404758 0.364904 Te\n0.574427 0.708226 0.892538 Te\n0.223834 0.042643 0.887769 Te\n0.894159 0.404758 0.864904 Te\n0.723834 0.957357 0.612231 Te\n0.105841 0.595242 0.135096 Te\n0.905490 0.239823 0.448156 Cl\n0.797997 0.558751 0.050763 Cl\n0.094510 0.760177 0.551844 Cl\n0.594510 0.239823 0.948156 Cl\n0.405490 0.760177 0.051844 Cl\n0.702003 0.558751 0.550763 Cl\n0.202003 0.441249 0.949237 Cl\n0.297997 0.441249 0.449237 Cl\n0.019720 0.124093 0.870515 O\n0.944411 0.991311 0.335446 O\n0.980280 0.875907 0.129485 O\n0.521113 0.381734 0.180287 O\n0.213720 0.889930 0.820692 O\n0.231260 0.672058 0.202005 O\n0.268740 0.672058 0.702005 O\n0.811018 0.721347 0.679853 O\n0.768740 0.327942 0.797995 O\n0.286280 0.889930 0.320692 O\n0.475664 0.586585 0.295621 O\n0.021113 0.618266 0.319713 O\n0.786280 0.110070 0.179308 O\n0.771323 0.683618 0.857641 O\n0.731260 0.327942 0.297995 O\n0.024336 0.586585 0.795621 O\n0.975664 0.413415 0.204379 O\n0.728677 0.683618 0.357641 O\n0.978887 0.381734 0.680287 O\n0.444411 0.008689 0.164554 O\n0.478887 0.618266 0.819713 O\n0.311018 0.278653 0.820147 O\n0.055589 0.008689 0.664554 O\n0.555589 0.991311 0.835446 O\n0.271323 0.316382 0.642359 O\n0.713720 0.110070 0.679308 O\n0.480280 0.124093 0.370515 O\n0.519720 0.875907 0.629485 O\n0.688982 0.721347 0.179853 O\n0.228677 0.316382 0.142359 O\n0.188982 0.278653 0.320147 O\n0.524336 0.413415 0.704379 O\n",
            "nsites": 64,
            "nelements": 5,
            "elements": [
                "Sr",
                "Ni",
                "Te",
                "Cl",
                "O"
            ],
            "chemical_system": "Cl-Ni-O-Sr-Te",
            "density": 4.65982088314783,
            "density_atomic": 0.05707245338174044,
            "volume": 1121.381615959687,
            "volume_molar": 10.55174677653984,
            "formula_full": "Sr4 Ni8 Te12 Cl8 O32",
            "formula_reduced": "SrNi2Te3(ClO4)2",
            "formula_anonymous": "AB2C2D3E8",
            "energy": -374.23805606,
            "energy_per_atom": -5.8474696259375,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -327.01405606,
            "band_gap": 3.1308,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 15.999592,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:42.426000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-1200095",
            "created_at": "2022-09-04T14:40:10.436491Z",
            "structure_string": "Sr4 Np4 P8 O32\n1.0\n4.520567 -5.314710 0.000000\n4.520567 5.314710 0.000000\n0.000000 0.000000 13.390688\nSr Np P O\n4 4 8 32\ndirect\n0.268946 0.768946 0.750000 Sr\n0.231054 0.731054 0.250000 Sr\n0.731054 0.231054 0.250000 Sr\n0.768946 0.268946 0.750000 Sr\n0.228189 0.228189 0.591202 Np\n0.771811 0.771811 0.408798 Np\n0.271811 0.271811 0.091202 Np\n0.728189 0.728189 0.908798 Np\n0.320177 0.320177 0.817197 P\n0.679823 0.679823 0.182803 P\n0.179823 0.179823 0.317197 P\n0.820177 0.820177 0.682803 P\n0.227166 0.772834 0.000000 P\n0.727166 0.272834 0.500000 P\n0.772834 0.227166 0.000000 P\n0.272834 0.727166 0.500000 P\n0.378891 0.146999 0.757590 O\n0.853001 0.621109 0.242410 O\n0.353001 0.121109 0.257590 O\n0.878891 0.646999 0.742410 O\n0.621109 0.853001 0.242410 O\n0.146999 0.378891 0.757590 O\n0.646999 0.878891 0.742410 O\n0.121109 0.353001 0.257590 O\n0.266056 0.266056 0.926536 O\n0.733944 0.733944 0.073464 O\n0.233944 0.233944 0.426536 O\n0.766056 0.766056 0.573464 O\n0.491752 0.491752 0.812340 O\n0.508248 0.508248 0.187660 O\n0.008248 0.008248 0.312340 O\n0.991752 0.991752 0.687660 O\n0.226201 0.939788 0.076904 O\n0.060212 0.773799 0.923096 O\n0.560212 0.273799 0.576904 O\n0.726201 0.439788 0.423096 O\n0.773799 0.060212 0.923096 O\n0.939788 0.226201 0.076904 O\n0.439788 0.726201 0.423096 O\n0.273799 0.560212 0.576904 O\n0.414072 0.793925 0.935669 O\n0.206075 0.585928 0.064331 O\n0.706075 0.085928 0.435669 O\n0.914072 0.293925 0.564331 O\n0.585928 0.206075 0.064331 O\n0.793925 0.414072 0.935669 O\n0.293925 0.914072 0.564331 O\n0.085928 0.706075 0.435669 O\n",
            "nsites": 48,
            "nelements": 4,
            "elements": [
                "Sr",
                "Np",
                "P",
                "O"
            ],
            "chemical_system": "Np-O-P-Sr",
            "density": 5.311803996770996,
            "density_atomic": 0.07459949167046165,
            "volume": 643.436019806098,
            "volume_molar": 8.07262975276348,
            "formula_full": "Sr4 Np4 P8 O32",
            "formula_reduced": "SrNp(PO4)2",
            "formula_anonymous": "ABC2D8",
            "energy": -413.76198815,
            "energy_per_atom": -8.620041419791667,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -391.77798815,
            "band_gap": 0.0314999999999994,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 11.9984562,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:55.284000Z",
            "spacegroup": 64
        },
        {
            "id": "mp-1179215",
            "created_at": "2022-09-04T14:39:08.759317Z",
            "structure_string": "Sr4 O40\n1.0\n6.882677 0.000000 0.000000\n0.000000 6.882677 0.000000\n0.000000 0.000000 11.782766\nSr O\n4 40\ndirect\n0.500000 0.500000 0.750000 Sr\n0.500000 0.500000 0.250000 Sr\n0.000000 0.000000 0.250000 Sr\n0.000000 0.000000 0.750000 Sr\n0.000000 0.500000 0.618712 O\n0.000000 0.500000 0.118712 O\n0.500000 0.000000 0.381288 O\n0.500000 0.000000 0.881288 O\n0.000000 0.500000 0.866555 O\n0.000000 0.500000 0.366555 O\n0.500000 0.000000 0.133445 O\n0.500000 0.000000 0.633445 O\n0.744895 0.653262 0.600268 O\n0.744895 0.346738 0.100268 O\n0.755105 0.846738 0.399732 O\n0.244895 0.846738 0.899732 O\n0.255105 0.346738 0.600268 O\n0.255105 0.653262 0.100268 O\n0.244895 0.153262 0.399732 O\n0.755105 0.153262 0.899732 O\n0.653262 0.255105 0.399732 O\n0.346738 0.255105 0.899732 O\n0.153262 0.755105 0.600268 O\n0.846738 0.755105 0.100268 O\n0.346738 0.744895 0.399732 O\n0.653262 0.744895 0.899732 O\n0.846738 0.244895 0.600268 O\n0.153262 0.244895 0.100268 O\n0.746554 0.660762 0.396197 O\n0.746554 0.339238 0.896197 O\n0.753446 0.839238 0.603803 O\n0.246554 0.839238 0.103803 O\n0.253446 0.339238 0.396197 O\n0.253446 0.660762 0.896197 O\n0.246554 0.160762 0.603803 O\n0.753446 0.160762 0.103803 O\n0.660762 0.253446 0.603803 O\n0.339238 0.253446 0.103803 O\n0.160762 0.753446 0.396197 O\n0.839238 0.753446 0.896197 O\n0.339238 0.746554 0.603803 O\n0.660762 0.746554 0.103803 O\n0.839238 0.246554 0.396197 O\n0.160762 0.246554 0.896197 O\n",
            "nsites": 44,
            "nelements": 2,
            "elements": [
                "Sr",
                "O"
            ],
            "chemical_system": "O-Sr",
            "density": 2.946607256890533,
            "density_atomic": 0.07882984014926851,
            "volume": 558.1642677022261,
            "volume_molar": 7.639417698420744,
            "formula_full": "Sr4 O40",
            "formula_reduced": "SrO10",
            "formula_anonymous": "AB10",
            "energy": -210.44572,
            "energy_per_atom": -4.782857272727273,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -204.00572,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0368252,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:30.721000Z",
            "spacegroup": 130
        },
        {
            "id": "mp-1201811",
            "created_at": "2022-09-04T14:46:11.052559Z",
            "structure_string": "Sr4 O40\n1.0\n6.844424 0.000000 0.000000\n0.000000 6.844424 0.000000\n0.000000 0.000000 11.979753\nSr O\n4 40\ndirect\n0.500000 0.500000 0.750000 Sr\n0.500000 0.500000 0.250000 Sr\n0.000000 0.000000 0.250000 Sr\n0.000000 0.000000 0.750000 Sr\n0.000000 0.500000 0.619174 O\n0.000000 0.500000 0.119174 O\n0.500000 0.000000 0.380826 O\n0.500000 0.000000 0.880826 O\n0.000000 0.500000 0.854526 O\n0.000000 0.500000 0.354526 O\n0.500000 0.000000 0.145474 O\n0.500000 0.000000 0.645474 O\n0.745632 0.652284 0.598708 O\n0.745632 0.347716 0.098708 O\n0.754368 0.847716 0.401292 O\n0.245632 0.847716 0.901292 O\n0.254368 0.347716 0.598708 O\n0.254368 0.652284 0.098708 O\n0.245632 0.152284 0.401292 O\n0.754368 0.152284 0.901292 O\n0.652284 0.254368 0.401292 O\n0.347716 0.254368 0.901292 O\n0.152284 0.754368 0.598708 O\n0.847716 0.754368 0.098708 O\n0.347716 0.745632 0.401292 O\n0.652284 0.745632 0.901292 O\n0.847716 0.245632 0.598708 O\n0.152284 0.245632 0.098708 O\n0.744422 0.661120 0.396717 O\n0.744422 0.338880 0.896717 O\n0.755578 0.838880 0.603283 O\n0.244422 0.838880 0.103283 O\n0.255578 0.338880 0.396717 O\n0.255578 0.661120 0.896717 O\n0.244422 0.161120 0.603283 O\n0.755578 0.161120 0.103283 O\n0.661120 0.255578 0.603283 O\n0.338880 0.255578 0.103283 O\n0.161120 0.755578 0.396717 O\n0.838880 0.755578 0.896717 O\n0.338880 0.744422 0.603283 O\n0.661120 0.744422 0.103283 O\n0.838880 0.244422 0.396717 O\n0.161120 0.244422 0.896717 O\n",
            "nsites": 44,
            "nelements": 2,
            "elements": [
                "Sr",
                "O"
            ],
            "chemical_system": "O-Sr",
            "density": 2.930640924176679,
            "density_atomic": 0.07840269688045999,
            "volume": 561.2051849069233,
            "volume_molar": 7.681037769889362,
            "formula_full": "Sr4 O40",
            "formula_reduced": "SrO10",
            "formula_anonymous": "AB10",
            "energy": -210.28723365,
            "energy_per_atom": -4.779255310227272,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -203.84723365,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0380852,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:16.420000Z",
            "spacegroup": 130
        },
        {
            "id": "mp-726705",
            "created_at": "2022-09-04T14:46:01.181851Z",
            "structure_string": "Sr4 O8\n1.0\n4.724219 0.000000 0.000000\n0.000000 4.946967 0.000000\n0.000000 0.000000 8.511161\nSr O\n4 8\ndirect\n0.890965 0.750000 0.146578 Sr\n0.609035 0.750000 0.646578 Sr\n0.109035 0.250000 0.853422 Sr\n0.390965 0.250000 0.353422 Sr\n0.534430 0.750000 0.355374 O\n0.965570 0.750000 0.855374 O\n0.465570 0.250000 0.644626 O\n0.034430 0.250000 0.144626 O\n0.222872 0.750000 0.395499 O\n0.277128 0.750000 0.895499 O\n0.777128 0.250000 0.604501 O\n0.722872 0.250000 0.104501 O\n",
            "nsites": 12,
            "nelements": 2,
            "elements": [
                "Sr",
                "O"
            ],
            "chemical_system": "O-Sr",
            "density": 3.9943920530620445,
            "density_atomic": 0.06032862192852087,
            "volume": 198.91056046693646,
            "volume_molar": 9.982228281519857,
            "formula_full": "Sr4 O8",
            "formula_reduced": "SrO2",
            "formula_anonymous": "AB2",
            "energy": -72.69192167,
            "energy_per_atom": -6.057660139166667,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -68.97192167,
            "band_gap": 2.7825,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0003515,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:20.983000Z",
            "spacegroup": 62
        },
        {
            "id": "mp-1247405",
            "created_at": "2022-09-04T14:41:34.380369Z",
            "structure_string": "Sr4 Os4 N8\n1.0\n6.455042 0.000000 0.390458\n0.000000 7.750998 0.000000\n-2.013771 0.000000 4.787746\nSr Os N\n4 4 8\ndirect\n0.326733 0.903281 0.665817 Sr\n0.673267 0.403281 0.834183 Sr\n0.673267 0.096719 0.334183 Sr\n0.326733 0.596719 0.165817 Sr\n0.124344 0.336082 0.537656 Os\n0.875656 0.836082 0.962344 Os\n0.875656 0.663918 0.462344 Os\n0.124344 0.163918 0.037656 Os\n0.191831 0.909218 0.100332 N\n0.808169 0.409218 0.399668 N\n0.808169 0.090782 0.899668 N\n0.191831 0.590782 0.600332 N\n0.317523 0.302307 0.930326 N\n0.682477 0.802307 0.569674 N\n0.682477 0.697693 0.069674 N\n0.317523 0.197693 0.430326 N\n",
            "nsites": 16,
            "nelements": 3,
            "elements": [
                "Sr",
                "Os",
                "N"
            ],
            "chemical_system": "N-Os-Sr",
            "density": 8.270611596505915,
            "density_atomic": 0.0651359884479923,
            "volume": 245.63993548321093,
            "volume_molar": 9.245489173482595,
            "formula_full": "Sr4 Os4 N8",
            "formula_reduced": "SrOsN2",
            "formula_anonymous": "ABC2",
            "energy": -123.80446208,
            "energy_per_atom": -7.73777888,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -120.91646208,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 3.65e-05,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:25.062000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-1105153",
            "created_at": "2022-09-04T14:45:23.741766Z",
            "structure_string": "Sr4 Os4 O12\n1.0\n5.585676 0.000000 0.000000\n0.000000 5.651719 0.000000\n0.000000 0.000000 7.970104\nSr Os O\n4 4 12\ndirect\n0.975593 0.503349 0.250000 Sr\n0.475593 0.996651 0.250000 Sr\n0.024407 0.496651 0.750000 Sr\n0.524407 0.003349 0.750000 Sr\n0.500000 0.500000 0.000000 Os\n0.000000 0.000000 0.500000 Os\n0.500000 0.500000 0.500000 Os\n0.000000 0.000000 0.000000 Os\n0.505840 0.430511 0.250000 O\n0.005840 0.069489 0.250000 O\n0.494160 0.569489 0.750000 O\n0.994160 0.930511 0.750000 O\n0.216102 0.716955 0.034515 O\n0.716102 0.783045 0.465485 O\n0.783898 0.283045 0.534515 O\n0.283898 0.216955 0.965485 O\n0.783898 0.283045 0.965485 O\n0.283898 0.216955 0.534515 O\n0.216102 0.716955 0.465485 O\n0.716102 0.783045 0.034515 O\n",
            "nsites": 20,
            "nelements": 3,
            "elements": [
                "Sr",
                "Os",
                "O"
            ],
            "chemical_system": "O-Os-Sr",
            "density": 8.602092833802455,
            "density_atomic": 0.07948948911432945,
            "volume": 251.60559242284313,
            "volume_molar": 7.576021467867754,
            "formula_full": "Sr4 Os4 O12",
            "formula_reduced": "SrOsO3",
            "formula_anonymous": "ABC3",
            "energy": -153.09880113,
            "energy_per_atom": -7.6549400565,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -144.85480113,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 4.2483181,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:05.653000Z",
            "spacegroup": 62
        },
        {
            "id": "mp-1208673",
            "created_at": "2022-09-04T14:48:04.079236Z",
            "structure_string": "Sr4 Os4 O8\n1.0\n-3.115943 3.115943 6.198946\n3.115943 -3.115943 6.198946\n3.115943 3.115943 -6.198946\nSr Os O\n4 4 8\ndirect\n0.875000 0.625000 0.250000 Sr\n0.375000 0.625000 0.750000 Sr\n0.375000 0.625000 0.250000 Sr\n0.375000 0.125000 0.750000 Sr\n0.375000 0.125000 0.250000 Os\n0.875000 0.125000 0.750000 Os\n0.875000 0.125000 0.250000 Os\n0.875000 0.625000 0.750000 Os\n0.173348 0.373338 0.199989 O\n0.173348 0.973359 0.800011 O\n0.123338 0.423348 0.699989 O\n0.576652 0.876662 0.300011 O\n0.723359 0.423348 0.300011 O\n0.576652 0.276641 0.699989 O\n0.626662 0.826652 0.800011 O\n0.026641 0.826652 0.199989 O\n",
            "nsites": 16,
            "nelements": 3,
            "elements": [
                "Sr",
                "Os",
                "O"
            ],
            "chemical_system": "O-Os-Sr",
            "density": 8.548738918952134,
            "density_atomic": 0.06646042728996977,
            "volume": 240.7447657564899,
            "volume_molar": 9.061242916367561,
            "formula_full": "Sr4 Os4 O8",
            "formula_reduced": "SrOsO2",
            "formula_anonymous": "ABC2",
            "energy": -114.91595082,
            "energy_per_atom": -7.18224692625,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -109.41995082,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 6.5979774,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:38:24.392000Z",
            "spacegroup": 141
        },
        {
            "id": "mp-569867",
            "created_at": "2022-09-04T14:44:12.090883Z",
            "structure_string": "Sr4 P12\n1.0\n3.724686 5.752166 0.000000\n-3.724686 5.752166 0.000000\n0.000000 2.007149 8.397616\nSr P\n4 12\ndirect\n0.958481 0.958481 0.741688 Sr\n0.292930 0.292930 0.774988 Sr\n0.707070 0.707070 0.225012 Sr\n0.041519 0.041519 0.258312 Sr\n0.638855 0.164833 0.024505 P\n0.904519 0.397003 0.512470 P\n0.673576 0.673576 0.837202 P\n0.602997 0.095481 0.487530 P\n0.582672 0.582672 0.632304 P\n0.326424 0.326424 0.162798 P\n0.397003 0.904519 0.512470 P\n0.417328 0.417328 0.367696 P\n0.361145 0.835167 0.975495 P\n0.095481 0.602997 0.487530 P\n0.164833 0.638855 0.024505 P\n0.835167 0.361145 0.975495 P\n",
            "nsites": 16,
            "nelements": 2,
            "elements": [
                "Sr",
                "P"
            ],
            "chemical_system": "P-Sr",
            "density": 3.3325642859683917,
            "density_atomic": 0.04446444727060607,
            "volume": 359.83804999589086,
            "volume_molar": 13.543721174244824,
            "formula_full": "Sr4 P12",
            "formula_reduced": "SrP3",
            "formula_anonymous": "AB3",
            "energy": -81.97420203,
            "energy_per_atom": -5.123387626875,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -81.97420203,
            "band_gap": 0.3683000000000005,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0020853,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:26.701000Z",
            "spacegroup": 12
        }
    ]
}