HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=3864",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=3862",
"results": [
{
"id": "jvasp-9226",
"created_at": "2022-09-04T14:37:15.380638Z",
"updated_at": "2022-09-04T14:37:15.380657Z",
"structure_string": "Mg2 Ta4 O12\n1.0\n0.000000 5.530529 -0.000136\n5.179123 0.000000 0.000000\n0.000000 -0.000235 -7.550636\nMg Ta O\n2 4 12\ndirect\n0.176962 0.466111 0.250002 Mg\n0.823037 0.966110 0.749999 Mg\n0.738638 0.489717 0.002399 Ta\n0.261361 0.989716 0.997602 Ta\n0.261359 0.989715 0.502403 Ta\n0.738640 0.489716 0.497598 Ta\n0.728169 0.351178 0.750001 O\n0.271830 0.851178 0.250000 O\n0.434585 0.321605 0.068061 O\n0.565415 0.821605 0.931940 O\n0.976634 0.225356 0.440687 O\n0.976635 0.225360 0.059316 O\n0.023364 0.725360 0.940685 O\n0.788638 0.598299 0.250001 O\n0.565415 0.821605 0.568061 O\n0.434584 0.321605 0.431940 O\n0.023365 0.725356 0.559314 O\n0.211362 0.098299 0.750000 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mg",
"Ta",
"O"
],
"chemical_system": "Mg-O-Ta",
"density": 7.4045267664798295,
"density_atomic": 0.08322735085769693,
"volume": 216.2750563907363,
"volume_molar": 7.235771291455286,
"formula_full": "Mg2 Ta4 O12",
"formula_reduced": "MgTa2O6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 3.2184642722222225,
"spacegroup": 31
},
{
"id": "jvasp-9793",
"created_at": "2022-09-04T14:37:16.089657Z",
"updated_at": "2022-09-04T14:37:16.089677Z",
"structure_string": "Cd2 Cu4 Si2 S8\n1.0\n6.298310 0.000000 0.000000\n0.000000 6.495611 0.000000\n0.000000 0.000000 7.656219\nCd Cu Si S\n2 4 2 8\ndirect\n0.126991 0.652239 0.000000 Cd\n0.626991 0.347761 0.500000 Cd\n0.130512 0.175780 0.748353 Cu\n0.630512 0.824220 0.751647 Cu\n0.130512 0.175780 0.251647 Cu\n0.630512 0.824220 0.248353 Cu\n0.122914 0.680507 0.500000 Si\n0.622914 0.319493 0.000000 Si\n0.032688 0.359357 0.500000 S\n0.464907 0.707922 0.500000 S\n0.964907 0.292078 0.000000 S\n0.495738 0.159492 0.224194 S\n0.495738 0.159492 0.775806 S\n0.995738 0.840508 0.724194 S\n0.532689 0.640643 0.000000 S\n0.995738 0.840508 0.275806 S\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Cd",
"Cu",
"Si",
"S"
],
"chemical_system": "Cd-Cu-S-Si",
"density": 4.197103779709508,
"density_atomic": 0.05108125912711227,
"volume": 313.22642145889705,
"volume_molar": 11.789334998603518,
"formula_full": "Cd2 Cu4 Si2 S8",
"formula_reduced": "CdCu2SiS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.08871490625,
"spacegroup": 31
},
{
"id": "jvasp-10155",
"created_at": "2022-09-04T14:37:16.564910Z",
"updated_at": "2022-09-04T14:37:16.564940Z",
"structure_string": "Li4 Cd2 Ge2 O8\n1.0\n5.184076 0.000000 0.000000\n0.000000 5.470342 0.000000\n0.000000 0.000000 6.697937\nLi Cd Ge O\n4 2 2 8\ndirect\n0.987889 0.329096 0.249942 Li\n0.487889 0.670903 0.749942 Li\n0.987889 0.329096 0.750058 Li\n0.487889 0.670903 0.250058 Li\n0.490476 0.184500 0.500000 Cd\n0.990476 0.815500 0.000000 Cd\n0.481664 0.186432 0.000000 Ge\n0.981664 0.813568 0.500000 Ge\n0.560878 0.866094 0.000000 O\n0.137257 0.205327 0.000000 O\n0.060877 0.133905 0.500000 O\n0.637257 0.794673 0.500000 O\n0.112975 0.661848 0.286898 O\n0.612975 0.338151 0.213103 O\n0.612975 0.338151 0.786898 O\n0.112975 0.661848 0.713103 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Cd",
"Ge",
"O"
],
"chemical_system": "Cd-Ge-Li-O",
"density": 4.597199266017553,
"density_atomic": 0.08423509805642623,
"volume": 189.94457618227193,
"volume_molar": 7.149206089801156,
"formula_full": "Li4 Cd2 Ge2 O8",
"formula_reduced": "Li2CdGeO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.2063974625,
"spacegroup": 31
},
{
"id": "jvasp-50438",
"created_at": "2022-09-04T14:37:17.878484Z",
"updated_at": "2022-09-04T14:37:17.878499Z",
"structure_string": "Li6 Sb2 S8\n1.0\n6.417641 0.000000 0.000000\n0.000000 6.825544 0.000000\n0.000000 0.000000 7.933875\nLi Sb S\n6 2 8\ndirect\n0.498039 0.843803 0.000000 Li\n0.002940 0.672618 0.246451 Li\n0.502939 0.327382 0.253549 Li\n0.998039 0.156196 0.500000 Li\n0.502939 0.327382 0.746451 Li\n0.002940 0.672618 0.753549 Li\n0.005320 0.170870 0.000000 Sb\n0.505319 0.829129 0.500000 Sb\n0.879618 0.843947 0.000000 S\n0.376057 0.179547 0.000000 S\n0.881993 0.334962 0.244705 S\n0.381993 0.665038 0.255296 S\n0.876057 0.820453 0.500000 S\n0.379618 0.156053 0.500000 S\n0.381993 0.665038 0.744705 S\n0.881993 0.334962 0.755296 S\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"Sb",
"S"
],
"chemical_system": "Li-S-Sb",
"density": 2.5882049600073,
"density_atomic": 0.04603858202805466,
"volume": 347.5345958798218,
"volume_molar": 13.080639095987518,
"formula_full": "Li6 Sb2 S8",
"formula_reduced": "Li3SbS4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 1.5227357625000002,
"spacegroup": 31
},
{
"id": "jvasp-9225",
"created_at": "2022-09-04T14:37:18.888967Z",
"updated_at": "2022-09-04T14:37:18.888996Z",
"structure_string": "Mg2 Sb4 O12\n1.0\n5.173546 0.000076 0.000024\n-0.000049 5.464969 0.000496\n-0.000063 -0.000732 7.550697\nMg Sb O\n2 4 12\ndirect\n0.469032 0.575744 0.750002 Mg\n0.969031 0.924264 0.250012 Mg\n0.495367 0.008735 0.998625 Sb\n0.995366 0.491271 0.001389 Sb\n0.995347 0.491274 0.498623 Sb\n0.495350 0.008736 0.501387 Sb\n0.349486 0.035666 0.250003 O\n0.849485 0.464342 0.750008 O\n0.325558 0.320400 0.931999 O\n0.825560 0.179605 0.068012 O\n0.207678 0.782995 0.569064 O\n0.207725 0.782961 0.930937 O\n0.707725 0.717044 0.069073 O\n0.613179 0.942436 0.750004 O\n0.825543 0.179600 0.431999 O\n0.325543 0.320410 0.568012 O\n0.707679 0.717018 0.430948 O\n0.113178 0.557573 0.250010 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mg",
"Sb",
"O"
],
"chemical_system": "Mg-O-Sb",
"density": 5.6598415013086205,
"density_atomic": 0.08431589233276042,
"volume": 213.48288563396025,
"volume_molar": 7.142355484103836,
"formula_full": "Mg2 Sb4 O12",
"formula_reduced": "Mg(SbO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.0167691388888893,
"spacegroup": 31
},
{
"id": "jvasp-10979",
"created_at": "2022-09-04T14:37:19.783478Z",
"updated_at": "2022-09-04T14:37:19.783499Z",
"structure_string": "Ag6 P2 S8\n1.0\n6.452646 0.000000 0.000000\n0.000000 6.974871 0.000000\n0.000000 0.000000 7.624750\nAg P S\n6 2 8\ndirect\n0.936179 0.789119 0.288045 Ag\n0.436179 0.210881 0.211955 Ag\n0.436179 0.210881 0.788045 Ag\n0.936179 0.789119 0.711955 Ag\n0.349468 0.658243 0.500000 Ag\n0.849468 0.341757 0.000000 Ag\n0.410343 0.699394 0.000000 P\n0.910343 0.300606 0.500000 P\n0.313954 0.853352 0.779707 S\n0.813955 0.146648 0.720293 S\n0.762529 0.565453 0.500000 S\n0.262529 0.434547 0.000000 S\n0.813955 0.146648 0.279707 S\n0.313954 0.853352 0.220293 S\n0.730298 0.690575 0.000000 S\n0.230298 0.309425 0.500000 S\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ag",
"P",
"S"
],
"chemical_system": "Ag-P-S",
"density": 4.672843464512751,
"density_atomic": 0.046625162070227745,
"volume": 343.16234602896355,
"volume_molar": 12.916074695739034,
"formula_full": "Ag6 P2 S8",
"formula_reduced": "Ag3PS4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 1.39364966,
"spacegroup": 31
},
{
"id": "jvasp-52438",
"created_at": "2022-09-04T14:37:27.240536Z",
"updated_at": "2022-09-04T14:37:27.240565Z",
"structure_string": "Mn2 P2 H12 N2 O10\n1.0\n4.848584 0.000000 0.000000\n0.000000 5.746654 0.000000\n0.000000 0.000000 8.901829\nMn P H N O\n2 2 12 2 10\ndirect\n0.530861 0.500000 0.025838 Mn\n0.030861 0.000000 0.974162 Mn\n0.092914 0.500000 0.800716 P\n0.592913 0.000000 0.199285 P\n0.580535 0.137195 0.803483 H\n0.580535 0.862804 0.803483 H\n0.080536 0.637195 0.196517 H\n0.137629 0.149145 0.591914 H\n0.137629 0.850854 0.591914 H\n0.080536 0.362805 0.196517 H\n0.637629 0.649145 0.408086 H\n0.964975 0.000000 0.456590 H\n0.464975 0.500000 0.543410 H\n0.324407 0.000000 0.461458 H\n0.824406 0.500000 0.538542 H\n0.637629 0.350854 0.408086 H\n0.641670 0.500000 0.473817 N\n0.141670 0.000000 0.526183 N\n0.738584 0.216357 0.126118 O\n0.738584 0.783643 0.126118 O\n0.238585 0.283643 0.873882 O\n0.238585 0.716356 0.873882 O\n0.783288 0.500000 0.833953 O\n0.141706 0.500000 0.628662 O\n0.283289 0.000000 0.166047 O\n0.202177 0.500000 0.209135 O\n0.641706 0.000000 0.371338 O\n0.702177 0.000000 0.790865 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Mn",
"P",
"H",
"N",
"O"
],
"chemical_system": "H-Mn-N-O-P",
"density": 2.489985162470236,
"density_atomic": 0.11288826813328168,
"volume": 248.03285995088316,
"volume_molar": 5.334602841891375,
"formula_full": "Mn2 P2 H12 N2 O10",
"formula_reduced": "MnPH6NO5",
"formula_anonymous": "ABCD5E6",
"energy_above_hull": 3.4279566779556654,
"spacegroup": 31
},
{
"id": "jvasp-9228",
"created_at": "2022-09-04T14:37:27.913988Z",
"updated_at": "2022-09-04T14:37:27.914016Z",
"structure_string": "Zn2 Sb4 O12\n1.0\n5.204190 0.000318 0.000205\n-0.000331 5.428520 0.000769\n-0.000292 -0.000964 7.590207\nZn Sb O\n2 4 12\ndirect\n0.477318 0.437628 0.249985 Zn\n0.977319 0.062368 0.749985 Zn\n0.496624 0.995581 0.001399 Sb\n0.996626 0.504430 0.998588 Sb\n0.996623 0.504412 0.501398 Sb\n0.496625 0.995566 0.498586 Sb\n0.355454 0.961636 0.749996 O\n0.855451 0.538357 0.249994 O\n0.323811 0.681218 0.066456 O\n0.823825 0.818805 0.933534 O\n0.200721 0.209340 0.431020 O\n0.200735 0.209369 0.068981 O\n0.700718 0.290659 0.931021 O\n0.613803 0.059309 0.249994 O\n0.823813 0.818776 0.566458 O\n0.323818 0.681189 0.433532 O\n0.700738 0.290624 0.568981 O\n0.113803 0.440683 0.749995 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Zn",
"Sb",
"O"
],
"chemical_system": "O-Sb-Zn",
"density": 6.2714201452253855,
"density_atomic": 0.08394296184785804,
"volume": 214.43131864496277,
"volume_molar": 7.174086579068768,
"formula_full": "Zn2 Sb4 O12",
"formula_reduced": "Zn(SbO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.9592748444444448,
"spacegroup": 31
},
{
"id": "jvasp-9229",
"created_at": "2022-09-04T14:37:27.785211Z",
"updated_at": "2022-09-04T14:37:27.785239Z",
"structure_string": "Ca2 Bi4 O12\n1.0\n5.638448 -0.000087 -0.000022\n0.000076 5.925600 -0.000042\n0.000047 0.000699 8.139937\nCa Bi O\n2 4 12\ndirect\n0.475188 0.421435 0.250056 Ca\n0.975190 0.078557 0.749932 Ca\n0.495125 0.986692 0.000662 Bi\n0.995126 0.513300 0.999328 Bi\n0.995024 0.513318 0.500634 Bi\n0.495024 0.986673 0.499355 Bi\n0.366956 0.965672 0.750016 O\n0.866956 0.534320 0.249973 O\n0.321860 0.680590 0.063433 O\n0.821861 0.819403 0.936557 O\n0.202608 0.211962 0.441580 O\n0.202826 0.212087 0.058548 O\n0.702827 0.287908 0.941441 O\n0.607659 0.044792 0.250019 O\n0.821667 0.819316 0.563508 O\n0.321667 0.680676 0.436481 O\n0.702610 0.288030 0.558409 O\n0.107660 0.455201 0.749968 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ca",
"Bi",
"O"
],
"chemical_system": "Bi-Ca-O",
"density": 6.765556043818531,
"density_atomic": 0.06618499645268296,
"volume": 271.96496131670233,
"volume_molar": 9.098951549095203,
"formula_full": "Ca2 Bi4 O12",
"formula_reduced": "Ca(BiO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.9272900022222228,
"spacegroup": 31
},
{
"id": "jvasp-9227",
"created_at": "2022-09-04T14:37:27.860123Z",
"updated_at": "2022-09-04T14:37:27.860151Z",
"structure_string": "Ca2 Sb4 O12\n1.0\n5.402822 -0.000235 0.000009\n0.000289 5.551863 -0.000072\n0.000014 0.000051 7.742915\nCa Sb O\n2 4 12\ndirect\n0.484354 0.437462 0.249994 Ca\n0.984353 0.062533 0.749993 Ca\n0.497699 0.991232 0.000524 Sb\n0.997698 0.508762 0.999464 Sb\n0.997698 0.508762 0.500524 Sb\n0.497700 0.991232 0.499464 Sb\n0.399959 0.977664 0.749993 O\n0.899958 0.522326 0.249994 O\n0.305059 0.696030 0.052097 O\n0.805061 0.803965 0.947891 O\n0.204493 0.208886 0.455789 O\n0.204492 0.208886 0.044199 O\n0.704492 0.291107 0.955788 O\n0.590092 0.024111 0.249994 O\n0.805059 0.803964 0.552098 O\n0.305057 0.696031 0.447890 O\n0.704493 0.291107 0.544199 O\n0.090093 0.475883 0.749993 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ca",
"Sb",
"O"
],
"chemical_system": "Ca-O-Sb",
"density": 5.427939481454624,
"density_atomic": 0.07750123301302557,
"volume": 232.25436938499746,
"volume_molar": 7.7703805808971635,
"formula_full": "Ca2 Sb4 O12",
"formula_reduced": "Ca(SbO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.059494846666667,
"spacegroup": 31
},
{
"id": "jvasp-10718",
"created_at": "2022-09-04T14:37:27.883843Z",
"updated_at": "2022-09-04T14:37:27.883858Z",
"structure_string": "Ag4 Sn2 Hg2 Se8\n1.0\n7.153936 0.000000 0.000000\n0.000000 7.492951 0.000000\n0.000000 0.000000 8.539940\nAg Sn Hg Se\n4 2 2 8\ndirect\n0.497419 0.821414 0.745084 Ag\n0.997420 0.178586 0.245084 Ag\n0.997420 0.178586 0.754916 Ag\n0.497419 0.821414 0.254916 Ag\n0.477969 0.332891 0.500000 Sn\n0.977969 0.667109 0.000000 Sn\n0.970536 0.649109 0.500000 Hg\n0.470535 0.350891 0.000000 Hg\n0.354502 0.656543 0.500000 Se\n0.854503 0.343457 0.000000 Se\n0.841325 0.314190 0.500000 Se\n0.341325 0.685810 0.000000 Se\n0.862917 0.843399 0.755861 Se\n0.862917 0.843399 0.244139 Se\n0.362917 0.156601 0.255861 Se\n0.362917 0.156601 0.744139 Se\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Ag",
"Sn",
"Hg",
"Se"
],
"chemical_system": "Ag-Hg-Se-Sn",
"density": 6.172950703585298,
"density_atomic": 0.034951612764794866,
"volume": 457.7757286243471,
"volume_molar": 17.229936714296123,
"formula_full": "Ag4 Sn2 Hg2 Se8",
"formula_reduced": "Ag2SnHgSe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.5268142858333333,
"spacegroup": 31
},
{
"id": "jvasp-21935",
"created_at": "2022-09-04T14:37:29.092839Z",
"updated_at": "2022-09-04T14:37:29.092862Z",
"structure_string": "Li6 P2 O8\n1.0\n4.850096 0.000000 0.000000\n0.000000 5.227208 0.000000\n0.000000 0.000000 6.095278\nLi P O\n6 2 8\ndirect\n0.509599 0.840818 0.000000 Li\n0.009599 0.159182 0.500000 Li\n0.508770 0.327793 0.252661 Li\n0.008769 0.672207 0.247339 Li\n0.008769 0.672207 0.752661 Li\n0.508770 0.327793 0.747340 Li\n0.501287 0.825626 0.500000 P\n0.001286 0.174374 0.000000 P\n0.107923 0.313961 0.790665 O\n0.603681 0.107738 0.500000 O\n0.180951 0.820297 0.500000 O\n0.680951 0.179703 0.000000 O\n0.607923 0.686039 0.290665 O\n0.107923 0.313961 0.209335 O\n0.103680 0.892263 0.000000 O\n0.607923 0.686039 0.709335 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"P",
"O"
],
"chemical_system": "Li-O-P",
"density": 2.488587254400712,
"density_atomic": 0.10353956780536223,
"volume": 154.53029541399508,
"volume_molar": 5.8162699416716315,
"formula_full": "Li6 P2 O8",
"formula_reduced": "Li3PO4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 1.8194099375,
"spacegroup": 31
}
]
}