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=1115",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=1113",
"results": [
{
"id": "jvasp-12899",
"created_at": "2022-09-04T14:38:33.425520Z",
"updated_at": "2022-09-04T14:38:33.425546Z",
"structure_string": "Rb4 I12\n1.0\n6.603756 0.000000 0.000000\n0.000000 9.734874 0.000000\n0.000000 0.000000 10.755909\nRb I\n4 12\ndirect\n0.250000 0.474845 0.830617 Rb\n0.750000 0.525154 0.169383 Rb\n0.750000 0.974845 0.669383 Rb\n0.250000 0.025155 0.330617 Rb\n0.250000 0.542730 0.374474 I\n0.750000 0.457269 0.625527 I\n0.750000 0.042730 0.125527 I\n0.250000 0.957269 0.874474 I\n0.250000 0.738896 0.578736 I\n0.750000 0.261104 0.421265 I\n0.750000 0.238896 0.921265 I\n0.250000 0.761103 0.078735 I\n0.250000 0.156523 0.655085 I\n0.750000 0.843477 0.344915 I\n0.750000 0.656522 0.844915 I\n0.250000 0.343477 0.155085 I\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Rb",
"I"
],
"chemical_system": "I-Rb",
"density": 4.47811643359675,
"density_atomic": 0.023139368926609744,
"volume": 691.4622456103531,
"volume_molar": 26.02551858307024,
"formula_full": "Rb4 I12",
"formula_reduced": "RbI3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-59588",
"created_at": "2022-09-04T14:38:33.431789Z",
"updated_at": "2022-09-04T14:38:33.431813Z",
"structure_string": "Yb4 Ni4 O12\n1.0\n5.128691 -0.000000 0.000000\n-0.000000 5.303795 0.000000\n0.000000 0.000000 7.314728\nYb Ni O\n4 4 12\ndirect\n0.017702 0.934018 0.750000 Yb\n0.517702 0.565981 0.250000 Yb\n0.482298 0.434018 0.750000 Yb\n0.982298 0.065981 0.250000 Yb\n0.000000 0.500000 0.500000 Ni\n0.500000 0.000000 0.500000 Ni\n0.500000 0.000000 0.000000 Ni\n0.000000 0.500000 0.000000 Ni\n0.587454 0.013252 0.750000 O\n0.087454 0.486747 0.250000 O\n0.696551 0.299161 0.042968 O\n0.196551 0.200839 0.957032 O\n0.803449 0.799160 0.457032 O\n0.196551 0.200839 0.542968 O\n0.303449 0.700839 0.957032 O\n0.803449 0.799160 0.042968 O\n0.912546 0.513252 0.750000 O\n0.696551 0.299161 0.457032 O\n0.303449 0.700839 0.542968 O\n0.412546 0.986747 0.250000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Yb",
"Ni",
"O"
],
"chemical_system": "Ni-O-Yb",
"density": 9.338114038712055,
"density_atomic": 0.1005167760694356,
"volume": 198.97176155136808,
"volume_molar": 5.991179776637473,
"formula_full": "Yb4 Ni4 O12",
"formula_reduced": "YbNiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.1809447199999998,
"spacegroup": 62
},
{
"id": "jvasp-119053",
"created_at": "2022-09-04T14:38:33.438428Z",
"updated_at": "2022-09-04T14:38:33.438450Z",
"structure_string": "K4 Hg24\n1.0\n5.434751 0.000000 0.000000\n0.000000 10.710299 0.000000\n-0.000000 -0.000000 14.312466\nK Hg\n4 24\ndirect\n0.250000 0.147308 0.825130 K\n0.250000 0.352692 0.325130 K\n0.750000 0.852692 0.174870 K\n0.750000 0.647308 0.674870 K\n0.250000 0.597584 0.493208 Hg\n0.250000 0.902416 -0.006792 Hg\n0.750000 0.006627 0.638467 Hg\n0.750000 0.493373 0.138467 Hg\n0.250000 -0.006627 0.361533 Hg\n0.250000 0.506627 0.861533 Hg\n0.750000 0.282041 0.706262 Hg\n0.750000 0.217959 0.206262 Hg\n0.250000 0.717959 0.293738 Hg\n0.250000 0.782041 0.793738 Hg\n0.750000 0.917132 0.843755 Hg\n0.250000 0.082868 0.156246 Hg\n0.750000 0.097584 0.006792 Hg\n0.250000 0.417132 0.656246 Hg\n0.750000 0.357284 0.917963 Hg\n0.750000 0.142716 0.417963 Hg\n0.250000 0.642717 0.082037 Hg\n0.250000 0.857284 0.582038 Hg\n0.750000 0.654630 0.944079 Hg\n0.750000 0.845370 0.444079 Hg\n0.250000 0.345370 0.055921 Hg\n0.250000 0.154630 0.555921 Hg\n0.750000 0.582868 0.343754 Hg\n0.750000 0.402416 0.506792 Hg\n",
"nsites": 28,
"nelements": 2,
"elements": [
"K",
"Hg"
],
"chemical_system": "Hg-K",
"density": 9.907363774823796,
"density_atomic": 0.03360952053642045,
"volume": 833.0972758048787,
"volume_molar": 17.917960934534005,
"formula_full": "K4 Hg24",
"formula_reduced": "KHg6",
"formula_anonymous": "AB6",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-57259",
"created_at": "2022-09-04T14:38:33.444139Z",
"updated_at": "2022-09-04T14:38:33.444161Z",
"structure_string": "V4 Cd4 Ag4 O16\n1.0\n5.496344 0.000000 0.000000\n-0.000000 7.004749 0.000000\n0.000000 0.000000 9.955601\nV Cd Ag O\n4 4 4 16\ndirect\n0.990268 0.750000 0.678530 V\n0.490269 0.250000 0.821470 V\n0.009731 0.250000 0.321470 V\n0.509730 0.750000 0.178530 V\n0.500000 0.500000 0.500000 Cd\n0.000000 0.500000 0.000000 Cd\n0.500000 0.000000 0.500000 Cd\n0.000000 0.000000 0.000000 Cd\n0.505545 0.750000 0.847750 Ag\n0.005545 0.250000 0.652250 Ag\n0.494454 0.250000 0.152250 Ag\n0.994454 0.750000 0.347750 Ag\n0.652645 0.550774 0.116705 O\n0.152646 0.449226 0.383295 O\n0.652645 0.949226 0.116705 O\n0.152646 0.050774 0.383295 O\n0.347354 0.449226 0.883295 O\n0.847354 0.550774 0.616705 O\n0.203277 0.750000 0.126904 O\n0.439481 0.250000 0.643805 O\n0.796722 0.250000 0.873096 O\n0.296722 0.750000 0.626904 O\n0.560518 0.750000 0.356195 O\n0.060518 0.250000 0.143805 O\n0.847354 0.949226 0.616705 O\n0.939481 0.750000 0.856195 O\n0.703277 0.250000 0.373096 O\n0.347354 0.050774 0.883295 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"V",
"Cd",
"Ag",
"O"
],
"chemical_system": "Ag-Cd-O-V",
"density": 5.809019594754694,
"density_atomic": 0.07305064664581304,
"volume": 383.29571722695823,
"volume_molar": 8.243788435163928,
"formula_full": "V4 Cd4 Ag4 O16",
"formula_reduced": "VCdAgO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.6863193157142855,
"spacegroup": 62
},
{
"id": "jvasp-116781",
"created_at": "2022-09-04T14:38:33.609677Z",
"updated_at": "2022-09-04T14:38:33.609704Z",
"structure_string": "Ca4 Cr4 O12\n1.0\n5.277239 0.000020 -0.000012\n-0.000021 5.352970 -0.000028\n0.000007 0.000037 7.483744\nCa Cr O\n4 4 12\ndirect\n0.991643 0.042138 0.249999 Ca\n0.491640 0.457861 0.750000 Ca\n0.508357 0.542143 0.249999 Ca\n0.008361 0.957857 0.750000 Ca\n0.500005 -0.000001 -0.000000 Cr\n-0.000004 0.500001 -0.000001 Cr\n0.000003 0.500004 0.500002 Cr\n0.499997 -0.000005 0.500001 Cr\n0.208867 0.209790 0.962074 O\n0.708866 0.290212 0.037926 O\n0.291135 0.709789 0.962074 O\n0.791136 0.790212 0.037926 O\n0.208865 0.209790 0.537925 O\n0.427386 0.985954 0.249999 O\n0.072615 0.485953 0.249999 O\n0.572617 0.014049 0.749999 O\n0.291134 0.709789 0.537925 O\n0.927384 0.514046 0.750000 O\n0.708865 0.290212 0.462074 O\n0.791134 0.790212 0.462074 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ca",
"Cr",
"O"
],
"chemical_system": "Ca-Cr-O",
"density": 4.4008934391240215,
"density_atomic": 0.09460400011038639,
"volume": 211.407551231063,
"volume_molar": 6.365630156201863,
"formula_full": "Ca4 Cr4 O12",
"formula_reduced": "CaCrO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.9337856639999995,
"spacegroup": 62
},
{
"id": "jvasp-119460",
"created_at": "2022-09-04T14:38:33.652093Z",
"updated_at": "2022-09-04T14:38:33.652119Z",
"structure_string": "K4 La4 F16\n1.0\n3.840310 -0.000000 0.000000\n0.000000 6.334715 0.000000\n-0.000000 -0.000000 15.568456\nK La F\n4 4 16\ndirect\n0.250000 0.723580 0.701689 K\n0.750000 0.276420 0.298312 K\n0.750000 0.776419 0.201688 K\n0.250000 0.223580 0.798312 K\n0.250000 0.251818 0.062779 La\n0.750000 0.748181 0.937221 La\n0.750000 0.248182 0.562779 La\n0.250000 0.751818 0.437221 La\n0.750000 0.413828 0.697885 F\n0.250000 0.586171 0.302115 F\n0.250000 0.005038 0.939778 F\n0.750000 0.994962 0.060222 F\n0.750000 0.494962 0.439778 F\n0.250000 0.505037 0.560222 F\n0.250000 0.139017 0.461300 F\n0.250000 0.101583 0.636884 F\n0.750000 0.360982 0.961300 F\n0.250000 0.639017 0.038701 F\n0.750000 0.913828 0.802115 F\n0.750000 0.898417 0.363116 F\n0.750000 0.398417 0.136884 F\n0.250000 0.601582 0.863117 F\n0.750000 0.860982 0.538701 F\n0.250000 0.086172 0.197885 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"K",
"La",
"F"
],
"chemical_system": "F-K-La",
"density": 4.454504715366621,
"density_atomic": 0.0633683405527403,
"volume": 378.7380226569961,
"volume_molar": 9.503390348352085,
"formula_full": "K4 La4 F16",
"formula_reduced": "KLaF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-20950",
"created_at": "2022-09-04T14:38:33.679109Z",
"updated_at": "2022-09-04T14:38:33.679142Z",
"structure_string": "U4 Mo4 C8\n1.0\n3.234552 0.000000 0.000000\n0.000000 5.643369 0.000000\n0.000000 0.000000 11.066644\nU Mo C\n4 4 8\ndirect\n0.250000 0.580533 0.642266 U\n0.749999 0.419467 0.357733 U\n0.250000 0.080533 0.857733 U\n0.749999 0.919467 0.142266 U\n0.749999 0.579406 0.899120 Mo\n0.749999 0.079406 0.600879 Mo\n0.250000 0.420594 0.100879 Mo\n0.250000 0.920595 0.399121 Mo\n0.250000 0.250834 0.506985 C\n0.749999 0.749167 0.493014 C\n0.250000 0.750834 0.993014 C\n0.749999 0.249166 0.006985 C\n0.250000 0.661768 0.255600 C\n0.749999 0.838232 0.755600 C\n0.250000 0.161768 0.244400 C\n0.749999 0.338232 0.744400 C\n",
"nsites": 16,
"nelements": 3,
"elements": [
"U",
"Mo",
"C"
],
"chemical_system": "C-Mo-U",
"density": 11.770958678547222,
"density_atomic": 0.07920479195858879,
"volume": 202.00797962281618,
"volume_molar": 7.6032530495738175,
"formula_full": "U4 Mo4 C8",
"formula_reduced": "UMoC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.897857975,
"spacegroup": 62
},
{
"id": "jvasp-10112",
"created_at": "2022-09-04T14:38:33.723242Z",
"updated_at": "2022-09-04T14:38:33.723270Z",
"structure_string": "Mg4 Cu4 P4\n1.0\n3.853653 -0.000000 0.000000\n-0.000000 6.560405 0.000000\n0.000000 0.000000 7.174810\nMg Cu P\n4 4 4\ndirect\n0.749999 0.466274 0.680543 Mg\n0.250000 0.533725 0.319457 Mg\n0.749999 0.966274 0.819457 Mg\n0.250000 0.033725 0.180543 Mg\n0.250000 0.124810 0.561862 Cu\n0.250000 0.624809 0.938138 Cu\n0.749999 0.375190 0.061862 Cu\n0.749999 0.875190 0.438138 Cu\n0.749999 0.249828 0.378143 P\n0.250000 0.250172 0.878143 P\n0.250000 0.750171 0.621857 P\n0.749999 0.749827 0.121857 P\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mg",
"Cu",
"P"
],
"chemical_system": "Cu-Mg-P",
"density": 4.3511332147570405,
"density_atomic": 0.0661557479757463,
"volume": 181.39013414827357,
"volume_molar": 9.102974335968218,
"formula_full": "Mg4 Cu4 P4",
"formula_reduced": "MgCuP",
"formula_anonymous": "ABC",
"energy_above_hull": 0.348815,
"spacegroup": 62
},
{
"id": "jvasp-59705",
"created_at": "2022-09-04T14:38:33.784550Z",
"updated_at": "2022-09-04T14:38:33.784570Z",
"structure_string": "Tb4 Mn4 Ge4\n1.0\n4.133028 0.000000 0.000000\n-0.000000 7.095945 0.000000\n0.000000 0.000000 7.830024\nTb Mn Ge\n4 4 4\ndirect\n0.250000 0.518160 0.184213 Tb\n0.750000 0.481841 0.815787 Tb\n0.250000 0.018160 0.315787 Tb\n0.750000 0.981841 0.684213 Tb\n0.750000 0.366377 0.443704 Mn\n0.250000 0.133624 0.943704 Mn\n0.750000 0.866377 0.056296 Mn\n0.250000 0.633624 0.556295 Mn\n0.250000 0.277244 0.615151 Ge\n0.750000 0.222756 0.115151 Ge\n0.250000 0.777244 0.884848 Ge\n0.750000 0.722757 0.384849 Ge\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"Ge"
],
"chemical_system": "Ge-Mn-Tb",
"density": 8.28699696950931,
"density_atomic": 0.052256409295245616,
"volume": 229.63690314427674,
"volume_molar": 11.524214620211009,
"formula_full": "Tb4 Mn4 Ge4",
"formula_reduced": "TbMnGe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7615971971264364,
"spacegroup": 62
},
{
"id": "jvasp-42032",
"created_at": "2022-09-04T14:38:33.744585Z",
"updated_at": "2022-09-04T14:38:33.744609Z",
"structure_string": "Pr12 Co4\n1.0\n0.000000 6.464995 -0.000471\n9.964659 -0.000000 -0.000000\n0.000000 -0.000695 -7.112515\nPr Co\n12 4\ndirect\n0.851432 0.250000 0.455764 Pr\n0.825826 0.930415 0.170743 Pr\n0.825826 0.569585 0.170743 Pr\n0.674177 0.930414 0.670746 Pr\n0.674177 0.569586 0.670746 Pr\n0.648564 0.250000 0.955768 Pr\n0.351435 0.750000 0.044232 Pr\n0.325822 0.430414 0.329255 Pr\n0.325822 0.069586 0.329255 Pr\n0.174173 0.430415 0.829257 Pr\n0.174173 0.069585 0.829257 Pr\n0.148566 0.750000 0.544237 Pr\n0.935223 0.750000 0.884397 Co\n0.564773 0.750000 0.384395 Co\n0.435226 0.250000 0.615605 Co\n0.064776 0.250000 0.115604 Co\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Pr",
"Co"
],
"chemical_system": "Co-Pr",
"density": 6.9822012289116255,
"density_atomic": 0.03491934988574192,
"volume": 458.19867930969224,
"volume_molar": 17.245855892806663,
"formula_full": "Pr12 Co4",
"formula_reduced": "Pr3Co",
"formula_anonymous": "AB3",
"energy_above_hull": 2.0656451125000004,
"spacegroup": 62
},
{
"id": "jvasp-56237",
"created_at": "2022-09-04T14:38:33.832498Z",
"updated_at": "2022-09-04T14:38:33.832514Z",
"structure_string": "Ni4 Te4 Pd4\n1.0\n3.828000 -0.000000 0.000000\n0.000000 6.344913 0.000000\n0.000000 0.000000 8.468532\nNi Te Pd\n4 4 4\ndirect\n0.750000 0.988814 0.395068 Ni\n0.250000 0.488814 0.104932 Ni\n0.750000 0.511185 0.895068 Ni\n0.250000 0.011185 0.604932 Ni\n0.750000 0.738900 0.157492 Te\n0.250000 0.261099 0.842507 Te\n0.750000 0.761099 0.657492 Te\n0.250000 0.238900 0.342507 Te\n0.750000 0.347243 0.584748 Pd\n0.750000 0.152757 0.084748 Pd\n0.250000 0.652757 0.415252 Pd\n0.250000 0.847243 0.915252 Pd\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ni",
"Te",
"Pd"
],
"chemical_system": "Ni-Pd-Te",
"density": 9.452484186804542,
"density_atomic": 0.05834122078895213,
"volume": 205.68647412109684,
"volume_molar": 10.322274163211189,
"formula_full": "Ni4 Te4 Pd4",
"formula_reduced": "NiTePd",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0009119555555557,
"spacegroup": 62
},
{
"id": "jvasp-21484",
"created_at": "2022-09-04T14:38:34.252327Z",
"updated_at": "2022-09-04T14:38:34.252363Z",
"structure_string": "Tl4 Cd4 Sb4\n1.0\n4.968744 0.000000 0.000000\n0.000000 8.383501 0.000000\n0.000000 0.000000 8.551049\nTl Cd Sb\n4 4 4\ndirect\n0.749999 0.997076 0.178509 Tl\n0.250000 0.002924 0.821491 Tl\n0.749999 0.497076 0.321491 Tl\n0.250000 0.502924 0.678509 Tl\n0.250000 0.660123 0.089480 Cd\n0.749999 0.839877 0.589480 Cd\n0.250000 0.160123 0.410520 Cd\n0.749999 0.339877 0.910520 Cd\n0.749999 0.703685 0.905855 Sb\n0.250000 0.796315 0.405855 Sb\n0.749999 0.203685 0.594146 Sb\n0.250000 0.296315 0.094146 Sb\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tl",
"Cd",
"Sb"
],
"chemical_system": "Cd-Sb-Tl",
"density": 8.177885493282714,
"density_atomic": 0.03368913102213093,
"volume": 356.1979675912984,
"volume_molar": 17.875619160505977,
"formula_full": "Tl4 Cd4 Sb4",
"formula_reduced": "TlCdSb",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 62
}
]
}