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=created_at&page=4375",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=created_at&page=4373",
"results": [
{
"id": "jvasp-118815",
"created_at": "2022-09-04T14:38:47.515189Z",
"updated_at": "2022-09-04T14:38:47.515221Z",
"structure_string": "Na1 Zn2\n1.0\n2.960241 0.000000 0.000000\n0.000000 2.853854 0.000000\n0.000000 0.000000 7.695012\nNa Zn\n1 2\ndirect\n0.466594 0.000000 0.000000 Na\n-0.033297 0.000000 0.663558 Zn\n-0.033297 0.000000 0.336442 Zn\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Na",
"Zn"
],
"chemical_system": "Na-Zn",
"density": 3.9287939179735574,
"density_atomic": 0.04614802641635119,
"volume": 65.00819716392115,
"volume_molar": 13.049617129165531,
"formula_full": "Na1 Zn2",
"formula_reduced": "NaZn2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4215800877192982,
"spacegroup": 47
},
{
"id": "jvasp-115632",
"created_at": "2022-09-04T14:38:47.516744Z",
"updated_at": "2022-09-04T14:38:47.516768Z",
"structure_string": "Ca1 Be1 Sb1\n1.0\n5.914864 -1.038069 0.000000\n-0.716087 4.044891 0.000000\n0.000000 0.000000 3.541276\nCa Be Sb\n1 1 1\ndirect\n0.456168 0.097975 0.000000 Ca\n-0.175017 -0.217603 0.000000 Be\n0.036005 0.387885 0.000000 Sb\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Be",
"Sb"
],
"chemical_system": "Be-Ca-Sb",
"density": 3.4558966919311835,
"density_atomic": 0.03654411618599286,
"volume": 82.09255861412464,
"volume_molar": 16.479098110760305,
"formula_full": "Ca1 Be1 Sb1",
"formula_reduced": "CaBeSb",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9228008733333336,
"spacegroup": 38
},
{
"id": "jvasp-116929",
"created_at": "2022-09-04T14:38:47.523765Z",
"updated_at": "2022-09-04T14:38:47.523774Z",
"structure_string": "Li6 Mn2 Co2 O10\n1.0\n2.825360 -0.092931 0.044396\n-1.247546 4.728656 -0.997175\n-0.201987 -0.115739 12.457146\nLi Mn Co O\n6 2 2 10\ndirect\n0.298560 0.597071 0.097782 Li\n0.900963 0.801781 0.296908 Li\n0.500855 0.001894 0.510110 Li\n0.099757 0.200246 0.708624 Li\n0.707571 0.415063 0.885771 Li\n0.392372 0.784327 0.793992 Li\n0.001176 0.002967 0.990877 Mn\n0.200479 0.400649 0.401327 Mn\n0.799568 0.598593 0.604288 Co\n0.599620 0.199382 0.200979 Co\n0.747434 0.494814 0.738356 O\n0.636077 0.272072 0.057163 O\n0.238404 0.476217 0.253548 O\n0.837420 0.673797 0.448568 O\n0.430488 0.859674 0.644434 O\n0.054615 0.109624 0.865360 O\n0.967458 0.935767 0.150310 O\n0.561580 0.123552 0.349481 O\n0.159310 0.318724 0.543187 O\n0.366269 0.733795 0.958936 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.3294059425003235,
"density_atomic": 0.1214408748206375,
"volume": 164.68919570563918,
"volume_molar": 4.958907590952734,
"formula_full": "Li6 Mn2 Co2 O10",
"formula_reduced": "Li3MnCoO5",
"formula_anonymous": "ABC3D5",
"energy_above_hull": 2.405321564137931,
"spacegroup": 8
},
{
"id": "jvasp-112253",
"created_at": "2022-09-04T14:38:47.523979Z",
"updated_at": "2022-09-04T14:38:47.524012Z",
"structure_string": "H16 C22 O6\n1.0\n6.443678 -0.025005 1.791581\n2.308635 6.185329 0.440661\n0.050380 0.028359 10.065331\nH C O\n16 22 6\ndirect\n0.826905 0.599599 0.615823 H\n0.138885 0.098585 0.863681 H\n0.861115 0.901416 0.136318 H\n0.825672 0.662769 0.982950 H\n0.384580 0.403673 0.058947 H\n0.615419 0.596328 0.941053 H\n0.103958 0.526901 0.153812 H\n0.896041 0.473100 0.846188 H\n0.174328 0.337232 0.017050 H\n0.717582 0.426682 0.329628 H\n0.385440 0.644982 0.214620 H\n0.614559 0.355020 0.785379 H\n0.338815 0.944810 0.050903 H\n0.661185 0.055191 0.949097 H\n0.173094 0.400402 0.384177 H\n0.282417 0.573319 0.670372 H\n0.228738 0.916315 0.671158 C\n0.789093 0.892165 0.413020 C\n0.210907 0.107836 0.586980 C\n0.756555 0.931659 0.560957 C\n0.807256 0.067911 0.178864 C\n0.773080 0.624219 0.896651 C\n0.226920 0.375782 0.103349 C\n0.192743 0.932091 0.821135 C\n0.771261 0.083687 0.328842 C\n0.243445 0.068342 0.439043 C\n0.274498 0.719655 0.612303 C\n0.316147 0.980336 0.159002 C\n0.299066 0.857735 0.389263 C\n0.700933 0.142266 0.610736 C\n0.339718 0.810866 0.249756 C\n0.660281 0.189135 0.750244 C\n0.683853 0.019665 0.840998 C\n0.255051 0.195906 0.204420 C\n0.744949 0.804095 0.795579 C\n0.221714 0.236431 0.344260 C\n0.778285 0.763570 0.655740 C\n0.725501 0.280346 0.387697 C\n0.827061 0.709868 0.364617 O\n0.687333 0.315161 0.523026 O\n0.312666 0.684840 0.476973 O\n0.781371 0.224630 0.102800 O\n0.218628 0.775371 0.897200 O\n0.172938 0.290133 0.635383 O\n",
"nsites": 44,
"nelements": 3,
"elements": [
"H",
"C",
"O"
],
"chemical_system": "C-H-O",
"density": 1.557624187804196,
"density_atomic": 0.10966401453163227,
"volume": 401.22550854919075,
"volume_molar": 5.49144656587684,
"formula_full": "H16 C22 O6",
"formula_reduced": "H8C11O3",
"formula_anonymous": "A3B8C11",
"energy_above_hull": 5.428774568181819,
"spacegroup": 2
},
{
"id": "jvasp-118784",
"created_at": "2022-09-04T14:38:47.524917Z",
"updated_at": "2022-09-04T14:38:47.524946Z",
"structure_string": "Na1 F1\n1.0\n3.211723 0.193279 -0.554165\n-1.286047 -2.766264 1.160216\n-0.605145 0.900462 -3.079859\nNa F\n1 1\ndirect\n0.941143 0.156150 0.098428 Na\n0.441133 0.156179 0.598444 F\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Na",
"F"
],
"chemical_system": "F-Na",
"density": 2.8255730038832603,
"density_atomic": 0.08105138832144466,
"volume": 24.67570317325259,
"volume_molar": 7.430027893065288,
"formula_full": "Na1 F1",
"formula_reduced": "NaF",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-117839",
"created_at": "2022-09-04T14:38:47.531572Z",
"updated_at": "2022-09-04T14:38:47.531598Z",
"structure_string": "P2 Br2\n1.0\n7.644966 -0.271926 -2.916699\n4.320168 -4.637121 -2.009370\n1.930390 -3.292828 -4.178526\nP Br\n2 2\ndirect\n0.668282 0.834594 -0.018549 P\n0.549189 0.454436 0.218073 P\n0.901584 0.052071 0.102869 Br\n0.315786 0.142604 0.190837 Br\n",
"nsites": 4,
"nelements": 2,
"elements": [
"P",
"Br"
],
"chemical_system": "Br-P",
"density": 3.3758941482802065,
"density_atomic": 0.03667121231907507,
"volume": 109.07738651223542,
"volume_molar": 16.42198438274018,
"formula_full": "P2 Br2",
"formula_reduced": "PBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.8840298025000002,
"spacegroup": 4
},
{
"id": "jvasp-111260",
"created_at": "2022-09-04T14:38:47.534856Z",
"updated_at": "2022-09-04T14:38:47.534885Z",
"structure_string": "Ce1 Ho1 Mg2\n1.0\n4.631547 -0.000000 2.674025\n1.543849 4.366665 2.674025\n-0.000000 -0.000000 5.348050\nCe Ho Mg\n1 1 2\ndirect\n0.500001 0.499999 0.500001 Ce\n0.000000 0.000000 0.000000 Ho\n0.750001 0.749999 0.750001 Mg\n0.250000 0.250000 0.250000 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ce",
"Ho",
"Mg"
],
"chemical_system": "Ce-Ho-Mg",
"density": 5.429490922349725,
"density_atomic": 0.03698184565267399,
"volume": 108.16117825938679,
"volume_molar": 16.284046006136975,
"formula_full": "Ce1 Ho1 Mg2",
"formula_reduced": "CeHoMg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4630497916666665,
"spacegroup": 225
},
{
"id": "jvasp-115748",
"created_at": "2022-09-04T14:38:47.536509Z",
"updated_at": "2022-09-04T14:38:47.536524Z",
"structure_string": "Ge1 C2\n1.0\n3.026721 0.000000 -0.270547\n0.000000 3.168583 0.000000\n0.355698 0.000000 3.978509\nGe C\n1 2\ndirect\n0.133334 0.000000 -0.200001 Ge\n-0.366683 0.000000 0.137784 C\n-0.366651 0.000000 0.462217 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ge",
"C"
],
"chemical_system": "C-Ge",
"density": 4.173375491391005,
"density_atomic": 0.07800214355112624,
"volume": 38.46048151271202,
"volume_molar": 7.720481112230985,
"formula_full": "Ge1 C2",
"formula_reduced": "GeC2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.182391983333332,
"spacegroup": 47
},
{
"id": "jvasp-112254",
"created_at": "2022-09-04T14:38:47.540840Z",
"updated_at": "2022-09-04T14:38:47.540871Z",
"structure_string": "H20 C20 O8\n1.0\n5.612637 -0.003392 1.007166\n1.496770 7.284752 2.038449\n-0.163130 -0.270576 10.333612\nH C O\n20 20 8\ndirect\n0.685558 0.917629 0.515702 H\n0.091959 0.240733 0.109299 H\n0.908042 0.759266 0.890701 H\n0.212748 0.396800 0.974994 H\n0.787252 0.603200 0.025006 H\n0.398193 0.176805 0.035200 H\n0.733248 0.096754 0.832328 H\n0.266753 0.903245 0.167672 H\n0.937638 0.187116 0.699990 H\n0.062363 0.812883 0.300010 H\n0.601807 0.823194 0.964801 H\n0.909178 0.523870 0.430819 H\n0.034693 0.769049 0.641011 H\n0.965307 0.230950 0.358990 H\n0.344730 0.812341 0.769818 H\n0.655270 0.187658 0.230182 H\n0.691810 0.560336 0.830311 H\n0.308191 0.439664 0.169690 H\n0.314443 0.082371 0.484299 H\n0.090822 0.476130 0.569181 H\n0.544088 0.811050 0.400211 C\n0.455913 0.188950 0.599789 C\n0.200426 0.779005 0.217875 C\n0.799574 0.220995 0.782125 C\n0.214322 0.251535 0.015352 C\n0.121069 0.173034 0.918919 C\n0.785678 0.748464 0.984649 C\n0.222336 0.495929 0.626275 C\n0.878932 0.826966 0.081081 C\n0.777665 0.504070 0.373725 C\n0.593199 0.374316 0.734826 C\n0.809205 0.339958 0.333140 C\n0.190796 0.660041 0.666861 C\n0.423105 0.353196 0.656768 C\n0.406801 0.625684 0.265174 C\n0.576896 0.646803 0.343233 C\n0.560837 0.541995 0.772217 C\n0.635974 0.315876 0.261586 C\n0.364026 0.684124 0.738415 C\n0.439163 0.458004 0.227783 C\n0.780418 0.968854 0.118915 O\n0.357775 0.935088 0.392850 O\n0.642226 0.064912 0.607150 O\n0.727461 0.813392 0.464743 O\n0.272540 0.186608 0.535257 O\n0.089684 0.721031 0.121829 O\n0.910317 0.278969 0.878171 O\n0.219582 0.031146 0.881086 O\n",
"nsites": 48,
"nelements": 3,
"elements": [
"H",
"C",
"O"
],
"chemical_system": "C-H-O",
"density": 1.5122697959788196,
"density_atomic": 0.11255841776823822,
"volume": 426.4452268584097,
"volume_molar": 5.350235797023909,
"formula_full": "H20 C20 O8",
"formula_reduced": "H5C5O2",
"formula_anonymous": "A2B5C5",
"energy_above_hull": 4.835013916666666,
"spacegroup": 2
},
{
"id": "jvasp-117746",
"created_at": "2022-09-04T14:38:47.544638Z",
"updated_at": "2022-09-04T14:38:47.544666Z",
"structure_string": "Rb1 Bi1 S1\n1.0\n5.647954 0.000000 0.000000\n-2.823977 4.891271 -0.000000\n-0.000000 -0.000000 3.712333\nRb Bi S\n1 1 1\ndirect\n0.333333 0.666666 0.000000 Rb\n0.000000 0.000000 0.000000 Bi\n0.666666 0.333333 0.000000 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"Bi",
"S"
],
"chemical_system": "Bi-Rb-S",
"density": 5.286765391703146,
"density_atomic": 0.029252396563081033,
"volume": 102.55569978790218,
"volume_molar": 20.586828662101638,
"formula_full": "Rb1 Bi1 S1",
"formula_reduced": "RbBiS",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5818081,
"spacegroup": 187
},
{
"id": "jvasp-113765",
"created_at": "2022-09-04T14:38:47.544836Z",
"updated_at": "2022-09-04T14:38:47.544867Z",
"structure_string": "Sn6 P2\n1.0\n6.528680 -0.000000 0.000000\n-3.264340 5.654003 0.000000\n0.000000 -0.000000 5.439810\nSn P\n6 2\ndirect\n0.828871 0.171129 0.750000 Sn\n0.342259 0.171129 0.750000 Sn\n0.828871 0.657741 0.750000 Sn\n0.171129 0.828871 0.250000 Sn\n0.657741 0.828871 0.250000 Sn\n0.171129 0.342259 0.250000 Sn\n0.666667 0.333333 0.250000 P\n0.333333 0.666667 0.750000 P\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sn",
"P"
],
"chemical_system": "P-Sn",
"density": 6.402378375627025,
"density_atomic": 0.039840505388971374,
"volume": 200.80066560135944,
"volume_molar": 15.115623411913456,
"formula_full": "Sn6 P2",
"formula_reduced": "Sn3P",
"formula_anonymous": "AB3",
"energy_above_hull": 1.1180326500000002,
"spacegroup": 194
},
{
"id": "jvasp-115572",
"created_at": "2022-09-04T14:38:47.545319Z",
"updated_at": "2022-09-04T14:38:47.545334Z",
"structure_string": "Ba1 Sn1 F1\n1.0\n3.652945 0.000000 0.000000\n0.000000 3.652945 -0.000000\n-0.000000 0.000000 8.037752\nBa Sn F\n1 1 1\ndirect\n0.000000 0.000000 0.414310 Ba\n0.000000 0.000000 -0.013332 Sn\n0.000000 0.000000 0.716468 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Sn",
"F"
],
"chemical_system": "Ba-F-Sn",
"density": 4.258109538961782,
"density_atomic": 0.0279705100423103,
"volume": 107.25582034299603,
"volume_molar": 21.530321581159786,
"formula_full": "Ba1 Sn1 F1",
"formula_reduced": "BaSnF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0390029449999999,
"spacegroup": 99
}
]
}