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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=4325",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=4323",
"results": [
{
"id": "jvasp-22549",
"created_at": "2022-09-04T14:37:31.113181Z",
"updated_at": "2022-09-04T14:37:31.113205Z",
"structure_string": "Ga4 Te6\n1.0\n8.474904 0.008726 0.006170\n6.367516 10.954432 -0.047498\n4.245012 4.853709 3.432090\nGa Te\n4 6\ndirect\n0.121408 0.993109 0.246179 Ga\n0.125913 0.667464 0.258119 Ga\n0.621408 0.340224 0.225507 Ga\n0.625913 0.665870 0.260511 Ga\n0.977230 0.004873 0.998342 Te\n0.010310 0.321406 0.037930 Te\n0.510309 0.011927 0.002149 Te\n0.015140 0.633789 0.028467 Te\n0.477231 0.328460 0.012961 Te\n0.515139 0.699545 0.929833 Te\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Ga",
"Te"
],
"chemical_system": "Ga-Te",
"density": 5.415108961996781,
"density_atomic": 0.031221443927910996,
"volume": 320.2926816289977,
"volume_molar": 19.288476131676905,
"formula_full": "Ga4 Te6",
"formula_reduced": "Ga2Te3",
"formula_anonymous": "A2B3",
"energy_above_hull": 0.3873976244444445,
"spacegroup": 9
},
{
"id": "jvasp-11409",
"created_at": "2022-09-04T14:37:32.212055Z",
"updated_at": "2022-09-04T14:37:32.212084Z",
"structure_string": "Si2 Cu4 S6\n1.0\n6.276560 0.030545 0.953356\n1.514591 5.330416 3.124386\n0.028631 0.010514 6.444514\nSi Cu S\n2 4 6\ndirect\n0.020607 0.060128 0.830377 Si\n0.520607 0.890505 0.169624 Si\n0.996790 0.752291 0.490202 Cu\n0.496790 0.242492 0.509799 Cu\n0.499715 0.586308 0.825047 Cu\n0.999715 0.411355 0.174954 Cu\n0.117486 0.353359 0.523228 S\n0.617486 0.876587 0.476773 S\n0.645667 0.185335 0.849308 S\n0.145666 0.034644 0.150692 S\n0.117037 0.709969 0.831253 S\n0.617037 0.541222 0.168748 S\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Si",
"Cu",
"S"
],
"chemical_system": "Cu-S-Si",
"density": 3.8832789175806157,
"density_atomic": 0.05581911846385541,
"volume": 214.9801059250043,
"volume_molar": 10.78867048733405,
"formula_full": "Si2 Cu4 S6",
"formula_reduced": "Cu2SiS3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.3902499166666666,
"spacegroup": 9
},
{
"id": "jvasp-35133",
"created_at": "2022-09-04T14:37:32.892428Z",
"updated_at": "2022-09-04T14:37:32.892451Z",
"structure_string": "Ca2 Al4 Si2 O12\n1.0\n0.015720 0.000000 5.307478\n-4.667894 4.341420 1.325676\n-4.667894 -4.341420 1.325676\nCa Al Si O\n2 4 2 12\ndirect\n0.240079 0.321256 0.693568 Ca\n0.740079 0.693568 0.321256 Ca\n0.210548 0.809151 0.612460 Al\n0.710549 0.612460 0.809151 Al\n0.261080 0.910861 0.088846 Al\n0.761080 0.088846 0.910861 Al\n0.281760 0.382543 0.188752 Si\n0.781760 0.188752 0.382543 Si\n0.623640 0.827491 0.975534 O\n0.012987 0.333390 0.358366 O\n0.700098 0.110052 0.626549 O\n0.874605 0.020083 0.200589 O\n0.512987 0.358366 0.333390 O\n0.322952 0.914228 0.358217 O\n0.374605 0.200589 0.020083 O\n0.972263 0.661034 0.607021 O\n0.822952 0.358217 0.914228 O\n0.123639 0.975534 0.827491 O\n0.200098 0.626549 0.110052 O\n0.472263 0.607021 0.661034 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ca",
"Al",
"Si",
"O"
],
"chemical_system": "Al-Ca-O-Si",
"density": 3.3646846295903647,
"density_atomic": 0.09289532317736934,
"volume": 215.29609151381146,
"volume_molar": 6.48271684087007,
"formula_full": "Ca2 Al4 Si2 O12",
"formula_reduced": "CaAl2SiO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.136462562,
"spacegroup": 9
},
{
"id": "jvasp-40903",
"created_at": "2022-09-04T14:37:35.402892Z",
"updated_at": "2022-09-04T14:37:35.402919Z",
"structure_string": "Bi4 Te4 O16\n1.0\n-0.000000 5.618429 -0.000000\n-6.457985 2.809214 0.037824\n2.099570 -2.809214 9.410169\nBi Te O\n4 4 16\ndirect\n0.229632 0.610818 0.155295 Bi\n0.042493 0.744670 0.744825 Bi\n0.957662 0.244669 0.244826 Bi\n0.314846 0.110818 0.655295 Bi\n0.652775 0.923483 0.384138 Te\n0.492539 0.505232 0.503642 Te\n0.807879 0.423483 0.884138 Te\n0.505871 0.005232 0.003642 Te\n0.353942 0.001996 0.154129 O\n0.702175 0.203849 0.415491 O\n0.347449 0.418217 0.620197 O\n0.083303 0.531208 0.903262 O\n0.519559 0.289299 0.085045 O\n0.798191 0.501997 0.654129 O\n0.200616 0.494671 0.343761 O\n0.276185 0.789300 0.585045 O\n0.911461 0.460029 0.091252 O\n0.636166 0.588970 0.380564 O\n0.288752 0.031207 0.403262 O\n0.648472 0.994672 0.843761 O\n0.719761 0.960029 0.591252 O\n0.854530 0.918218 0.120196 O\n0.509467 0.703850 0.915491 O\n0.155429 0.088970 0.880564 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Bi",
"Te",
"O"
],
"chemical_system": "Bi-O-Te",
"density": 7.782509734029906,
"density_atomic": 0.07019961520691793,
"volume": 341.88221586768583,
"volume_molar": 8.578595113732957,
"formula_full": "Bi4 Te4 O16",
"formula_reduced": "BiTeO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.905097677777778,
"spacegroup": 9
},
{
"id": "jvasp-54741",
"created_at": "2022-09-04T14:37:35.638220Z",
"updated_at": "2022-09-04T14:37:35.638245Z",
"structure_string": "Sr2 H8 O12\n1.0\n3.640143 4.727629 0.400017\n-3.640143 4.727629 -0.400017\n0.215543 0.000000 6.083840\nSr H O\n2 8 12\ndirect\n0.816545 0.814592 0.768609 Sr\n0.185408 0.183455 0.268609 Sr\n-0.086264 0.614503 0.240293 H\n0.704167 0.012666 0.292648 H\n-0.012666 0.295833 0.792648 H\n0.385496 0.086263 0.740294 H\n0.669096 0.392573 0.105607 H\n0.607427 0.330904 0.605607 H\n0.338863 0.729822 0.432534 H\n0.270178 0.661137 0.932534 H\n0.432540 0.167142 0.594129 O\n0.051633 0.438162 0.949512 O\n0.377738 0.944220 0.907188 O\n0.746970 0.400321 0.596075 O\n0.599680 0.253030 0.096075 O\n0.235850 0.729912 0.313385 O\n0.270088 0.764150 0.813385 O\n0.928343 0.201926 0.653568 O\n0.798074 0.071657 0.153568 O\n0.832859 0.567459 0.094129 O\n0.055780 0.622262 0.407188 O\n0.561839 0.948367 0.449512 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Sr",
"H",
"O"
],
"chemical_system": "H-O-Sr",
"density": 2.9877752329821616,
"density_atomic": 0.10547443321760325,
"volume": 208.58135311912054,
"volume_molar": 5.709573947248222,
"formula_full": "Sr2 H8 O12",
"formula_reduced": "Sr(H2O3)2",
"formula_anonymous": "AB4C6",
"energy_above_hull": 2.570408846363636,
"spacegroup": 9
},
{
"id": "jvasp-9858",
"created_at": "2022-09-04T14:37:35.804798Z",
"updated_at": "2022-09-04T14:37:35.804816Z",
"structure_string": "Ca4 Al2 Sb2 O10\n1.0\n5.565718 0.000795 0.020078\n-0.000806 5.873850 -0.003983\n-2.181183 -2.932132 7.587959\nCa Al Sb O\n4 2 2 10\ndirect\n0.176574 0.645760 0.252088 Ca\n0.393729 0.894807 0.740197 Ca\n0.893729 0.343272 0.740206 Ca\n0.676578 0.104208 0.252085 Ca\n0.260504 0.303765 0.483932 Al\n0.760504 0.678043 0.483931 Al\n0.537938 0.487432 0.006928 Sb\n0.037945 0.017370 0.006927 Sb\n0.376168 0.284752 0.117226 O\n0.192076 0.640778 0.979040 O\n0.711266 0.950375 0.636545 O\n0.142165 0.052519 0.276110 O\n0.573113 0.435163 0.507807 O\n0.642183 0.721479 0.276110 O\n0.073110 0.570516 0.507803 O\n0.876170 0.330346 0.117212 O\n0.211266 0.184055 0.636549 O\n0.692070 0.836140 0.979030 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ca",
"Al",
"Sb",
"O"
],
"chemical_system": "Al-Ca-O-Sb",
"density": 4.132223189944278,
"density_atomic": 0.07250483236339837,
"volume": 248.2593147692966,
"volume_molar": 8.305847436232504,
"formula_full": "Ca4 Al2 Sb2 O10",
"formula_reduced": "Ca2AlSbO5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 1.6063496933333332,
"spacegroup": 9
},
{
"id": "jvasp-40900",
"created_at": "2022-09-04T14:37:36.784140Z",
"updated_at": "2022-09-04T14:37:36.784167Z",
"structure_string": "Li2 Si2 Bi2 O8\n1.0\n5.067155 -0.004352 0.009945\n-2.537347 4.394814 -0.019889\n0.001979 -0.003428 8.171641\nLi Si Bi O\n2 2 2 8\ndirect\n0.406513 0.691483 0.046688 Li\n0.593486 0.284970 0.546688 Li\n0.290450 0.646465 0.452055 Si\n0.709548 0.356014 0.952055 Si\n0.069669 0.977923 0.214270 Bi\n-0.069671 0.908253 0.714270 Bi\n-0.037900 0.634667 0.486128 O\n0.394189 0.816116 0.271326 O\n0.535963 0.883104 0.588619 O\n0.254120 0.306891 0.452396 O\n0.464035 0.347140 0.088619 O\n0.605809 0.421925 0.771326 O\n0.745879 0.052772 -0.047604 O\n0.037899 0.672567 -0.013872 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Si",
"Bi",
"O"
],
"chemical_system": "Bi-Li-O-Si",
"density": 5.623910713798682,
"density_atomic": 0.07697156166974914,
"volume": 181.88535734883223,
"volume_molar": 7.823851600982629,
"formula_full": "Li2 Si2 Bi2 O8",
"formula_reduced": "LiSiBiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.014920985714286,
"spacegroup": 9
},
{
"id": "jvasp-58324",
"created_at": "2022-09-04T14:37:37.993661Z",
"updated_at": "2022-09-04T14:37:37.993678Z",
"structure_string": "K2 Li2 S2 O8\n1.0\n5.075636 0.000000 0.054462\n2.537818 4.469259 0.027231\n-0.044531 0.000000 8.677431\nK Li S O\n2 2 2 8\ndirect\n0.960990 0.008686 0.494388 K\n0.969676 0.991314 0.994388 K\n0.632703 0.664452 0.308572 Li\n0.297155 0.335548 0.808572 Li\n0.298232 0.334009 0.197727 S\n0.632242 0.665991 0.697727 S\n0.013017 0.336755 0.240120 O\n0.349773 0.663245 0.740120 O\n0.562859 0.055295 0.254450 O\n0.618155 0.944705 0.754450 O\n0.663629 0.654920 0.527422 O\n0.318548 0.345080 0.027423 O\n0.898168 0.400697 0.764319 O\n0.298864 0.599303 0.264319 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"K",
"Li",
"S",
"O"
],
"chemical_system": "K-Li-O-S",
"density": 2.397385657411563,
"density_atomic": 0.07111921601997423,
"volume": 196.85256367376184,
"volume_molar": 8.467670338644691,
"formula_full": "K2 Li2 S2 O8",
"formula_reduced": "KLiSO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.555040285714286,
"spacegroup": 9
},
{
"id": "jvasp-31165",
"created_at": "2022-09-04T14:37:40.617191Z",
"updated_at": "2022-09-04T14:37:40.617217Z",
"structure_string": "Br2 O4 F2\n1.0\n6.335131 -0.040192 -0.018465\n4.285520 4.733666 -0.057608\n4.292226 1.861517 4.271697\nBr O F\n2 4 2\ndirect\n0.276798 0.221275 0.245728 Br\n0.745728 0.721276 0.776797 Br\n0.089117 0.504953 0.777464 O\n0.491201 0.785887 0.094010 O\n0.277463 0.004953 0.589118 O\n0.594011 0.285887 0.991202 O\n0.781627 0.109088 0.486452 F\n0.986452 0.609089 0.281626 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Br",
"O",
"F"
],
"chemical_system": "Br-F-O",
"density": 3.3504338315718076,
"density_atomic": 0.061654999815201776,
"volume": 129.75427822525927,
"volume_molar": 9.767481596058929,
"formula_full": "Br2 O4 F2",
"formula_reduced": "BrO2F",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.101695346875,
"spacegroup": 9
},
{
"id": "jvasp-24990",
"created_at": "2022-09-04T14:37:43.024220Z",
"updated_at": "2022-09-04T14:37:43.024247Z",
"structure_string": "Sr2 Li2 B6 S12\n1.0\n7.142332 0.039644 3.081928\n1.868619 7.309193 4.278039\n0.012839 0.000381 8.672802\nSr Li B S\n2 2 6 12\ndirect\n0.974407 0.137810 0.380924 Sr\n0.474407 0.380923 0.137811 Sr\n0.936572 0.489188 0.705990 Li\n0.436572 0.705989 0.489189 Li\n0.943400 0.014105 0.026579 B\n0.041942 0.758489 0.839157 B\n0.541942 0.839156 0.758489 B\n0.023163 0.604587 0.248433 B\n0.443400 0.026578 0.014106 B\n0.523163 0.248433 0.604587 B\n0.436439 0.253671 0.829846 S\n0.936439 0.829845 0.253673 S\n0.076276 0.731811 0.637709 S\n0.087594 0.403698 0.441286 S\n0.563478 0.052639 0.555141 S\n0.587594 0.441286 0.403698 S\n0.063478 0.555141 0.052640 S\n0.576276 0.637709 0.731811 S\n0.992843 0.992310 0.813490 S\n0.492843 0.813489 0.992311 S\n0.405377 0.017022 0.236252 S\n0.905377 0.236252 0.017023 S\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Sr",
"Li",
"B",
"S"
],
"chemical_system": "B-Li-S-Sr",
"density": 2.347604621830689,
"density_atomic": 0.04869175047909192,
"volume": 451.8219161056189,
"volume_molar": 12.36788716927704,
"formula_full": "Sr2 Li2 B6 S12",
"formula_reduced": "SrLi(BS2)3",
"formula_anonymous": "ABC3D6",
"energy_above_hull": 2.650552187272728,
"spacegroup": 9
},
{
"id": "jvasp-52465",
"created_at": "2022-09-04T14:37:44.147050Z",
"updated_at": "2022-09-04T14:37:44.147070Z",
"structure_string": "Rb4 Zr2 O6\n1.0\n3.276634 6.481985 0.457677\n-3.276634 6.481985 -0.457677\n-1.752381 0.000000 5.629148\nRb Zr O\n4 2 6\ndirect\n0.622110 0.554836 0.532018 Rb\n0.256429 0.234840 0.526647 Rb\n0.445165 0.377891 0.032018 Rb\n0.765161 0.743572 0.026646 Rb\n0.985228 0.912274 0.534617 Zr\n0.087726 0.014773 0.034617 Zr\n0.259680 0.799539 0.779518 O\n0.200462 0.740321 0.279518 O\n0.844699 0.752132 0.538380 O\n0.812384 0.129308 0.786622 O\n0.247868 0.155302 0.038380 O\n0.870692 0.187617 0.286622 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Rb",
"Zr",
"O"
],
"chemical_system": "O-Rb-Zr",
"density": 4.128268233822302,
"density_atomic": 0.04809360733350429,
"volume": 249.51341072808714,
"volume_molar": 12.52170734093529,
"formula_full": "Rb4 Zr2 O6",
"formula_reduced": "Rb2ZrO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.3483108333333331,
"spacegroup": 9
},
{
"id": "jvasp-49927",
"created_at": "2022-09-04T14:37:50.259359Z",
"updated_at": "2022-09-04T14:37:50.259382Z",
"structure_string": "Bi4 Se2 O12\n1.0\n5.746835 -0.116874 -0.000109\n-0.107347 5.760967 0.000112\n2.873614 -0.058866 7.862414\nBi Se O\n4 2 12\ndirect\n0.124775 0.502829 0.655289 Bi\n0.621863 0.010281 0.656322 Bi\n0.280064 0.002820 0.344711 Bi\n0.778184 0.510269 0.343682 Bi\n0.002749 0.085609 0.050824 Se\n0.553574 0.585638 -0.050825 Se\n0.160045 0.283444 0.129237 O\n0.473016 0.608279 0.161734 O\n0.451096 0.264410 0.505665 O\n0.456771 0.764410 0.494332 O\n-0.043936 0.248091 0.496931 O\n0.789230 0.783523 0.870766 O\n0.676872 0.337802 0.855439 O\n0.032253 0.837756 0.144551 O\n0.134762 0.108255 0.838265 O\n0.348764 0.659228 0.858135 O\n-0.047009 0.748093 0.503073 O\n0.706916 0.159267 0.141864 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Bi",
"Se",
"O"
],
"chemical_system": "Bi-O-Se",
"density": 7.567539825083192,
"density_atomic": 0.0691757821233305,
"volume": 260.20667128719384,
"volume_molar": 8.705562228791843,
"formula_full": "Bi4 Se2 O12",
"formula_reduced": "Bi2SeO6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.198664774074074,
"spacegroup": 9
}
]
}