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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=4341",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=4339",
"results": [
{
"id": "jvasp-42946",
"created_at": "2022-09-04T14:38:13.535934Z",
"updated_at": "2022-09-04T14:38:13.535960Z",
"structure_string": "Li4 Ti3 V3 Cr2 O16\n1.0\n5.830139 -0.000792 0.000540\n-2.914414 5.053909 0.002804\n-0.000963 -0.016588 9.521066\nLi Ti V Cr O\n4 3 3 2 16\ndirect\n0.669004 0.338023 0.893798 Li\n0.996468 0.992963 0.993911 Li\n-0.001945 -0.003875 0.498044 Li\n0.335061 0.670157 0.394016 Li\n0.340722 0.175861 0.215787 Ti\n0.835037 0.175783 0.215799 Ti\n0.166446 0.332904 0.717526 Ti\n0.650719 0.829839 0.709809 V\n0.179101 0.829837 0.709810 V\n0.830960 0.661887 0.208741 V\n0.669518 0.339053 0.487480 Cr\n0.334491 0.669004 0.984106 Cr\n0.164793 0.329619 0.100445 O\n0.163555 0.832284 0.103053 O\n0.328485 0.656985 0.596596 O\n0.479082 0.519627 0.840998 O\n0.040527 0.519630 0.841000 O\n0.835915 0.671847 0.604198 O\n0.962743 0.483419 0.340873 O\n0.521343 0.042718 0.340681 O\n0.832177 0.165901 0.601341 O\n-0.003481 -0.006938 0.809809 O\n0.001992 0.003993 0.313685 O\n0.661820 0.323647 0.099380 O\n0.482112 0.964242 0.841684 O\n0.333707 0.165900 0.601341 O\n0.520662 0.483431 0.340874 O\n0.668709 0.832264 0.103055 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"Ti",
"V",
"Cr",
"O"
],
"chemical_system": "Cr-Li-O-Ti-V",
"density": 4.050010166506657,
"density_atomic": 0.09981589086952763,
"volume": 280.516456408726,
"volume_molar": 6.033248521391972,
"formula_full": "Li4 Ti3 V3 Cr2 O16",
"formula_reduced": "Li4Ti3V3Cr2O16",
"formula_anonymous": "A2B3C3D4E16",
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"spacegroup": 8
},
{
"id": "jvasp-10734",
"created_at": "2022-09-04T14:38:14.427411Z",
"updated_at": "2022-09-04T14:38:14.427427Z",
"structure_string": "Ca1 Sb4 O8\n1.0\n3.250893 -0.000038 -0.000081\n-1.625261 7.964010 -0.052142\n-1.625178 -2.421378 7.727750\nCa Sb O\n1 4 8\ndirect\n0.522871 0.106278 0.939587 Ca\n0.739423 0.136644 0.342323 Sb\n0.620934 0.499349 0.742650 Sb\n0.335704 0.496293 0.175252 Sb\n0.188309 0.830594 0.546186 Sb\n0.532796 0.644665 0.421066 O\n0.794447 0.351401 0.237618 O\n0.165003 0.642799 0.687348 O\n0.410694 0.301887 0.519632 O\n0.113369 0.070316 0.156525 O\n0.133642 0.325948 0.941463 O\n0.835312 0.940244 0.730537 O\n0.879359 0.629686 0.129171 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Ca",
"Sb",
"O"
],
"chemical_system": "Ca-O-Sb",
"density": 5.44846027089127,
"density_atomic": 0.0651105993502925,
"volume": 199.6602723630373,
"volume_molar": 9.249094341154988,
"formula_full": "Ca1 Sb4 O8",
"formula_reduced": "Ca(SbO2)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 2.2652871400000003,
"spacegroup": 8
},
{
"id": "jvasp-46519",
"created_at": "2022-09-04T14:38:15.141367Z",
"updated_at": "2022-09-04T14:38:15.141398Z",
"structure_string": "Li1 Mn4 O8\n1.0\n2.881545 0.001027 0.000690\n-1.438026 -6.926490 -0.276630\n-1.439314 -0.105472 -6.666195\nLi Mn O\n1 4 8\ndirect\n-0.016871 -0.057907 -0.041285 Li\n0.392387 0.533945 0.185243 Mn\n0.202549 0.824859 0.514691 Mn\n0.870748 0.185134 0.490792 Mn\n0.680795 0.474762 0.821256 Mn\n0.878879 0.662483 0.029738 O\n0.581673 0.737881 0.359904 O\n0.836657 0.945461 0.662285 O\n0.894471 0.405908 0.317424 O\n0.180625 0.605541 0.690171 O\n0.240188 0.063832 0.350987 O\n0.492798 0.273569 0.646457 O\n0.197607 0.354179 0.975421 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Li",
"Mn",
"O"
],
"chemical_system": "Li-Mn-O",
"density": 4.430032288844422,
"density_atomic": 0.0977809350032307,
"volume": 132.9502525167148,
"volume_molar": 6.15880872871693,
"formula_full": "Li1 Mn4 O8",
"formula_reduced": "LiMn4O8",
"formula_anonymous": "AB4C8",
"energy_above_hull": 3.3460205358090187,
"spacegroup": 8
},
{
"id": "jvasp-51716",
"created_at": "2022-09-04T14:38:15.400946Z",
"updated_at": "2022-09-04T14:38:15.400972Z",
"structure_string": "Rb6 H10 Pd2\n1.0\n7.685193 -0.000000 0.000000\n-0.000000 7.685193 0.000000\n0.000000 0.000000 6.013351\nRb H Pd\n6 10 2\ndirect\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Rb\n0.184561 0.684560 0.500000 Rb\n0.815439 0.315439 0.500000 Rb\n0.684560 0.815439 0.500000 Rb\n0.315439 0.184561 0.500000 Rb\n0.109871 0.390128 0.193285 H\n0.890128 0.609871 0.193285 H\n0.609871 0.109871 0.193285 H\n0.390128 0.890128 0.193285 H\n0.890128 0.609871 0.806715 H\n0.609871 0.109871 0.806715 H\n0.390128 0.890128 0.806715 H\n0.500000 0.000000 0.000000 H\n0.000000 0.000000 0.500000 H\n0.500000 0.500000 0.500000 H\n0.109871 0.390128 0.806715 Pd\n0.000000 0.500000 0.000000 Pd\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Rb",
"H",
"Pd"
],
"chemical_system": "H-Pd-Rb",
"density": 3.439847648815048,
"density_atomic": 0.050681142161717804,
"volume": 355.1616880015062,
"volume_molar": 11.882409320579297,
"formula_full": "Rb6 H10 Pd2",
"formula_reduced": "Rb3H5Pd",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.5058795222222223,
"spacegroup": 8
},
{
"id": "jvasp-46642",
"created_at": "2022-09-04T14:38:15.901369Z",
"updated_at": "2022-09-04T14:38:15.901389Z",
"structure_string": "Li4 V2 Cr3 Fe3 O16\n1.0\n5.693578 -0.012893 0.000850\n-2.857894 4.950010 0.000064\n0.001146 0.000523 9.311598\nLi V Cr Fe O\n4 2 3 3 16\ndirect\n0.343996 0.672007 0.891123 Li\n0.990189 0.995108 0.995884 Li\n0.987206 0.993618 0.494398 Li\n0.675571 0.337795 0.396464 Li\n0.335948 0.667986 0.497635 V\n0.673219 0.336622 0.993200 V\n0.179411 0.833294 0.214562 Cr\n0.179414 0.346137 0.214565 Cr\n0.336730 0.168375 0.714441 Cr\n0.829950 0.177968 0.714836 Fe\n0.647821 0.823919 0.212842 Fe\n0.829948 0.651999 0.714834 Fe\n0.339166 0.169600 0.095463 O\n0.826352 0.661442 0.099901 O\n0.668663 0.334342 0.603855 O\n0.520969 0.042426 0.840061 O\n0.520967 0.478563 0.840056 O\n0.659600 0.829809 0.601535 O\n0.486823 0.523127 0.344276 O\n0.045706 0.522861 0.341194 O\n0.165230 0.336705 0.595829 O\n0.986883 0.993448 0.807217 O\n0.992419 0.996219 0.304348 O\n0.332906 0.666466 0.097193 O\n0.966532 0.483275 0.842115 O\n0.165233 0.828543 0.595831 O\n0.486822 0.963712 0.344272 O\n0.826355 0.164937 0.099904 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"V",
"Cr",
"Fe",
"O"
],
"chemical_system": "Cr-Fe-Li-O-V",
"density": 4.493102922447296,
"density_atomic": 0.10683428328866491,
"volume": 262.08815314784624,
"volume_molar": 5.636899106374169,
"formula_full": "Li4 V2 Cr3 Fe3 O16",
"formula_reduced": "Li4V2Cr3Fe3O16",
"formula_anonymous": "A2B3C3D4E16",
"energy_above_hull": 3.3510826107142857,
"spacegroup": 8
},
{
"id": "jvasp-110232",
"created_at": "2022-09-04T14:38:16.254825Z",
"updated_at": "2022-09-04T14:38:16.254843Z",
"structure_string": "K3 Sn1 Sb3\n1.0\n9.069327 0.011372 0.850196\n8.020735 4.233277 0.850196\n-0.024106 -0.005987 6.938617\nK Sn Sb\n3 1 3\ndirect\n0.001933 0.001933 0.996334 K\n0.706057 0.706057 0.751704 K\n0.288979 0.288979 0.255730 K\n0.086964 0.086964 0.511227 Sn\n0.369760 0.369759 0.752542 Sb\n0.625670 0.625670 0.240699 Sb\n0.920634 0.920635 0.491769 Sb\n",
"nsites": 7,
"nelements": 3,
"elements": [
"K",
"Sn",
"Sb"
],
"chemical_system": "K-Sb-Sn",
"density": 3.7556718201661723,
"density_atomic": 0.026330328684547835,
"volume": 265.8531188069827,
"volume_molar": 22.8714986134379,
"formula_full": "K3 Sn1 Sb3",
"formula_reduced": "K3SnSb3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 0.4010132446428573,
"spacegroup": 8
},
{
"id": "jvasp-110209",
"created_at": "2022-09-04T14:38:17.050713Z",
"updated_at": "2022-09-04T14:38:17.050734Z",
"structure_string": "Mn1 Cr2 Se3 S1\n1.0\n6.156738 -0.033337 2.988411\n5.084630 3.471753 2.988411\n0.014230 0.004353 6.292883\nMn Cr Se S\n1 2 3 1\ndirect\n0.998784 0.998779 0.985951 Mn\n0.744125 0.744122 0.238457 Cr\n0.261828 0.261826 0.760808 Cr\n0.123181 0.123180 0.206061 Se\n0.636289 0.636286 0.696527 Se\n0.369665 0.369664 0.297607 Se\n0.866138 0.866134 0.814586 S\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Mn",
"Cr",
"Se",
"S"
],
"chemical_system": "Cr-Mn-S-Se",
"density": 5.246976229775666,
"density_atomic": 0.0516940880786453,
"volume": 135.41200280679064,
"volume_molar": 11.649573449942976,
"formula_full": "Mn1 Cr2 Se3 S1",
"formula_reduced": "MnCr2Se3S",
"formula_anonymous": "ABC2D3",
"energy_above_hull": 3.1645245916256157,
"spacegroup": 8
},
{
"id": "jvasp-108787",
"created_at": "2022-09-04T14:38:17.225764Z",
"updated_at": "2022-09-04T14:38:17.225775Z",
"structure_string": "La1 Pb1 N1 O5\n1.0\n7.045853 -0.151322 1.053742\n5.581447 4.302834 1.053742\n-0.141189 -0.046419 3.871294\nLa Pb N O\n1 1 1 5\ndirect\n0.832274 0.832273 0.164958 La\n0.171036 0.171036 0.740829 Pb\n0.485573 0.485572 0.493962 N\n0.274696 0.274696 0.200447 O\n0.739614 0.739614 0.706224 O\n0.554475 0.554474 0.245324 O\n0.684990 0.215343 0.620124 O\n0.215343 0.684990 0.620124 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"La",
"Pb",
"N",
"O"
],
"chemical_system": "La-N-O-Pb",
"density": 6.0213832556623945,
"density_atomic": 0.0659138595963129,
"volume": 121.37052888414847,
"volume_molar": 9.136380113199849,
"formula_full": "La1 Pb1 N1 O5",
"formula_reduced": "LaPbNO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 2.60716957125,
"spacegroup": 8
},
{
"id": "jvasp-108082",
"created_at": "2022-09-04T14:38:17.669123Z",
"updated_at": "2022-09-04T14:38:17.669156Z",
"structure_string": "Sm2 Al1 Ag3\n1.0\n4.682788 0.018003 3.447847\n2.346152 4.052703 3.447847\n0.030998 0.017952 7.160316\nSm Al Ag\n2 1 3\ndirect\n0.461013 0.461012 0.294672 Sm\n0.542046 0.542044 0.707057 Sm\n0.829640 0.829638 0.115718 Al\n0.150074 0.150073 0.888983 Ag\n0.177272 0.177272 0.281530 Ag\n0.839957 0.839954 0.712046 Ag\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sm",
"Al",
"Ag"
],
"chemical_system": "Ag-Al-Sm",
"density": 8.010670448572219,
"density_atomic": 0.04444120715058045,
"volume": 135.00983399641146,
"volume_molar": 13.550803738510385,
"formula_full": "Sm2 Al1 Ag3",
"formula_reduced": "Sm2AlAg3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.6648570550000001,
"spacegroup": 8
},
{
"id": "jvasp-42543",
"created_at": "2022-09-04T14:38:17.734649Z",
"updated_at": "2022-09-04T14:38:17.734672Z",
"structure_string": "Li2 Fe3 O3 F5\n1.0\n5.853781 0.000557 0.000506\n-2.926549 -5.085777 0.048397\n-2.926555 1.661896 -4.780917\nLi Fe O F\n2 3 3 5\ndirect\n0.741360 0.626644 0.377119 Li\n0.262404 0.626646 0.377117 Li\n0.225844 0.585070 0.866616 Fe\n0.507799 0.253107 0.762510 Fe\n0.764507 0.149663 0.379351 Fe\n0.754600 0.365209 0.610349 O\n0.755817 0.360863 0.150770 O\n0.220966 0.365220 0.610350 O\n0.230262 0.845319 0.615201 F\n0.723948 0.882045 0.136290 F\n0.278295 0.411629 0.144964 F\n0.739813 0.896556 0.583075 F\n0.294376 0.882025 0.136284 F\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Li",
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-Li-O",
"density": 3.797766831278571,
"density_atomic": 0.09164991068317992,
"volume": 141.84410986431905,
"volume_molar": 6.570809196767952,
"formula_full": "Li2 Fe3 O3 F5",
"formula_reduced": "Li2Fe3O3F5",
"formula_anonymous": "A2B3C3D5",
"energy_above_hull": 1.5582706471153838,
"spacegroup": 8
},
{
"id": "jvasp-44135",
"created_at": "2022-09-04T14:38:17.827000Z",
"updated_at": "2022-09-04T14:38:17.827009Z",
"structure_string": "Li4 Mn3 Fe2 Cu3 O16\n1.0\n-5.648288 -0.003003 0.001179\n2.821350 5.091525 0.094542\n-0.001772 -0.379694 -9.227918\nLi Mn Fe Cu O\n4 3 2 3 16\ndirect\n0.661686 0.323339 0.101479 Li\n0.991856 0.983686 0.001883 Li\n0.008787 0.017566 0.512594 Li\n0.344864 0.689718 0.600046 Li\n0.825636 0.651250 0.785461 Mn\n0.663144 0.832006 0.286393 Mn\n0.168880 0.832003 0.286392 Mn\n0.667868 0.335718 0.516561 Fe\n0.323617 0.647206 0.010098 Fe\n0.170992 0.341958 0.288379 Cu\n0.833007 0.171076 0.791366 Cu\n0.338093 0.171077 0.791365 Cu\n0.159713 0.319389 0.923638 O\n0.638285 0.784538 0.909080 O\n0.346576 0.693126 0.393000 O\n0.039903 0.530731 0.156809 O\n0.490865 0.530739 0.156808 O\n0.840364 0.680701 0.395263 O\n0.542900 0.511208 0.641799 O\n0.532549 0.065085 0.642509 O\n0.337558 0.161299 0.404057 O\n0.992882 0.985749 0.190962 O\n0.992800 0.985580 0.703949 O\n0.673053 0.346082 0.888299 O\n0.476074 0.952135 0.159033 O\n0.823745 0.161300 0.404054 O\n0.968326 0.511200 0.641805 O\n0.146273 0.784535 0.909082 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"Mn",
"Fe",
"Cu",
"O"
],
"chemical_system": "Cu-Fe-Li-Mn-O",
"density": 4.703518006251741,
"density_atomic": 0.10562133307722243,
"volume": 265.09796065088943,
"volume_molar": 5.701632979387848,
"formula_full": "Li4 Mn3 Fe2 Cu3 O16",
"formula_reduced": "Li4Mn3Fe2Cu3O16",
"formula_anonymous": "A2B3C3D4E16",
"energy_above_hull": 2.6798671455049257,
"spacegroup": 8
},
{
"id": "jvasp-53341",
"created_at": "2022-09-04T14:38:18.386926Z",
"updated_at": "2022-09-04T14:38:18.386947Z",
"structure_string": "Bi2 O3\n1.0\n3.411862 -0.067445 1.981211\n1.108776 3.136091 1.920455\n-0.174841 -0.268219 8.220766\nBi O\n2 3\ndirect\n0.008844 0.973428 0.022150 Bi\n0.940816 0.018186 0.511404 Bi\n0.151948 0.254959 0.169067 O\n0.618904 0.704355 0.486193 O\n0.689491 0.799066 0.856188 O\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Bi",
"O"
],
"chemical_system": "Bi-O",
"density": 8.516386830580274,
"density_atomic": 0.055033683519460225,
"volume": 90.85344974649882,
"volume_molar": 10.942645258100043,
"formula_full": "Bi2 O3",
"formula_reduced": "Bi2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.67671982,
"spacegroup": 8
}
]
}