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=-density&page=3594",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=3592",
"results": [
{
"id": "jvasp-86810",
"created_at": "2022-09-04T14:35:49.300074Z",
"updated_at": "2022-09-04T14:35:49.300106Z",
"structure_string": "Rb6 Bi2\n1.0\n6.432406 -0.000000 -0.000000\n-3.216203 5.570628 -0.000000\n-0.000000 -0.000000 11.370204\nRb Bi\n6 2\ndirect\n0.333334 0.666667 0.917981 Rb\n0.666668 0.333333 0.417981 Rb\n0.000000 0.000000 0.250000 Rb\n0.666668 0.333333 0.082019 Rb\n0.000000 0.000000 0.750000 Rb\n0.333334 0.666667 0.582019 Rb\n0.666668 0.333333 0.750000 Bi\n0.333334 0.666667 0.250000 Bi\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Rb",
"Bi"
],
"chemical_system": "Bi-Rb",
"density": 3.793538462705742,
"density_atomic": 0.019635597636860427,
"volume": 407.42330067826424,
"volume_molar": 30.66950581985388,
"formula_full": "Rb6 Bi2",
"formula_reduced": "Rb3Bi",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0003374999999999,
"spacegroup": 194
},
{
"id": "jvasp-86208",
"created_at": "2022-09-04T14:38:16.809830Z",
"updated_at": "2022-09-04T14:38:16.809852Z",
"structure_string": "Rb6 Bi2\n1.0\n6.432406 -0.000000 -0.000000\n-3.216203 5.570628 0.000000\n-0.000000 -0.000000 11.370204\nRb Bi\n6 2\ndirect\n0.333334 0.666667 0.917981 Rb\n0.666668 0.333333 0.417981 Rb\n0.000000 0.000000 0.250000 Rb\n0.666668 0.333333 0.082019 Rb\n0.000000 0.000000 0.750000 Rb\n0.333334 0.666667 0.582019 Rb\n0.666668 0.333333 0.750000 Bi\n0.333334 0.666667 0.250000 Bi\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Rb",
"Bi"
],
"chemical_system": "Bi-Rb",
"density": 3.793538462705742,
"density_atomic": 0.019635597636860427,
"volume": 407.42330067826424,
"volume_molar": 30.66950581985388,
"formula_full": "Rb6 Bi2",
"formula_reduced": "Rb3Bi",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0003374999999999,
"spacegroup": 194
},
{
"id": "jvasp-36505",
"created_at": "2022-09-04T14:37:30.914168Z",
"updated_at": "2022-09-04T14:37:30.914194Z",
"structure_string": "Ba3 Sb1 As1\n1.0\n6.434781 0.000000 0.000000\n0.000000 6.434781 -0.000000\n-0.000000 0.000000 6.434781\nBa Sb As\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n0.500000 0.500000 0.500000 Sb\n0.000000 0.000000 0.000000 As\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Sb",
"As"
],
"chemical_system": "As-Ba-Sb",
"density": 3.7933629830033055,
"density_atomic": 0.018765869502507505,
"volume": 266.4411579400516,
"volume_molar": 32.09092314744765,
"formula_full": "Ba3 Sb1 As1",
"formula_reduced": "Ba3SbAs",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.5914171520000001,
"spacegroup": 221
},
{
"id": "jvasp-92937",
"created_at": "2022-09-04T14:35:50.653431Z",
"updated_at": "2022-09-04T14:35:50.653454Z",
"structure_string": "Mg6 Ga1 Bi1\n1.0\n6.393597 -0.130471 0.000000\n-3.309789 5.732722 0.000000\n0.000000 0.000000 5.130765\nMg Ga Bi\n6 1 1\ndirect\n0.672127 0.334045 0.250000 Mg\n0.672127 0.838081 0.250000 Mg\n0.333585 0.183885 0.750001 Mg\n0.333585 0.649699 0.750001 Mg\n0.833720 0.166861 0.750001 Mg\n0.823826 0.661914 0.750001 Mg\n0.161907 0.330953 0.250000 Ga\n0.169125 0.834562 0.250000 Bi\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Ga",
"Bi"
],
"chemical_system": "Bi-Ga-Mg",
"density": 3.7933228578288705,
"density_atomic": 0.04304758910533833,
"volume": 185.84083722839475,
"volume_molar": 13.989496009320517,
"formula_full": "Mg6 Ga1 Bi1",
"formula_reduced": "Mg6GaBi",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0002975,
"spacegroup": 38
},
{
"id": "jvasp-114715",
"created_at": "2022-09-04T14:38:41.748761Z",
"updated_at": "2022-09-04T14:38:41.748795Z",
"structure_string": "Ca1 Ti1 N2\n1.0\n3.124765 0.000000 -0.000000\n-0.000000 3.124765 0.000000\n-0.000000 0.000000 5.198756\nCa Ti N\n1 1 2\ndirect\n0.499999 0.499999 0.527481 Ca\n0.000000 0.000000 0.067503 Ti\n0.000000 0.000000 0.408965 N\n0.499999 0.499999 0.006051 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Ti",
"N"
],
"chemical_system": "Ca-N-Ti",
"density": 3.793299677949679,
"density_atomic": 0.07879993036595868,
"volume": 50.76146617672631,
"volume_molar": 7.642317362505622,
"formula_full": "Ca1 Ti1 N2",
"formula_reduced": "CaTiN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.058148813333333,
"spacegroup": 99
},
{
"id": "jvasp-11189",
"created_at": "2022-09-04T14:37:07.326401Z",
"updated_at": "2022-09-04T14:37:07.326427Z",
"structure_string": "Na2 Al2 As2 O8 F2\n1.0\n5.240504 -0.007305 -1.415237\n-1.811880 4.917319 -1.415237\n-0.011797 -0.016894 7.076529\nNa Al As O F\n2 2 2 8 2\ndirect\n0.328958 0.671043 0.750000 Na\n0.671041 0.328959 0.250000 Na\n0.000000 0.000000 0.000000 Al\n-0.000000 0.000000 0.500000 Al\n0.313819 0.686181 0.250000 As\n0.686180 0.313821 0.750000 As\n0.097518 0.693538 0.389233 O\n0.306462 0.902482 0.110766 O\n0.902481 0.306464 0.610766 O\n0.693537 0.097520 0.889234 O\n0.363671 0.237073 0.581652 O\n0.636328 0.762929 0.418347 O\n0.762928 0.636330 0.918347 O\n0.237072 0.363672 0.081652 O\n0.066296 0.933705 0.750000 F\n0.933704 0.066297 0.250000 F\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Na",
"Al",
"As",
"O",
"F"
],
"chemical_system": "Al-As-F-Na-O",
"density": 3.7932363886081206,
"density_atomic": 0.08790619319663755,
"volume": 182.01220435299214,
"volume_molar": 6.850644466572521,
"formula_full": "Na2 Al2 As2 O8 F2",
"formula_reduced": "NaAlAsO4F",
"formula_anonymous": "ABCDE4",
"energy_above_hull": 1.5653084790624998,
"spacegroup": 15
},
{
"id": "jvasp-10085",
"created_at": "2022-09-04T14:38:33.080452Z",
"updated_at": "2022-09-04T14:38:33.080476Z",
"structure_string": "Rb4 Ti2 Cu4 S8\n1.0\n5.608815 -0.000000 0.000000\n0.000000 5.608815 0.000000\n0.000000 0.000000 13.196719\nRb Ti Cu S\n4 2 4 8\ndirect\n0.762132 0.762132 0.000000 Rb\n0.237869 0.762132 0.500000 Rb\n0.762132 0.237869 0.500000 Rb\n0.237869 0.237869 0.000000 Rb\n0.500000 0.500000 0.750000 Ti\n0.500000 0.500000 0.250000 Ti\n0.500000 0.000000 0.250000 Cu\n0.000000 0.500000 0.250000 Cu\n0.000000 0.500000 0.750000 Cu\n0.500000 0.000000 0.750000 Cu\n0.262075 0.737926 0.152074 S\n0.737926 0.737926 0.652074 S\n0.262075 0.262075 0.652074 S\n0.737926 0.737926 0.347926 S\n0.737926 0.262075 0.152074 S\n0.262075 0.737926 0.847926 S\n0.262075 0.262075 0.347926 S\n0.737926 0.262075 0.847926 S\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Rb",
"Ti",
"Cu",
"S"
],
"chemical_system": "Cu-Rb-S-Ti",
"density": 3.793070029414163,
"density_atomic": 0.04335750717974043,
"volume": 415.15301895425443,
"volume_molar": 13.88949953934149,
"formula_full": "Rb4 Ti2 Cu4 S8",
"formula_reduced": "Rb2Ti(CuS2)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 1.0116876925925926,
"spacegroup": 132
},
{
"id": "jvasp-19057",
"created_at": "2022-09-04T14:37:05.072991Z",
"updated_at": "2022-09-04T14:37:05.073016Z",
"structure_string": "K4 Au4 S20\n1.0\n7.507025 0.000000 3.308164\n2.398058 8.906969 4.729935\n-0.085470 0.052936 10.365662\nK Au S\n4 4 20\ndirect\n0.000000 0.500000 0.500000 K\n0.500000 0.000000 -0.000000 K\n0.250000 0.750000 0.750000 K\n0.750000 0.250000 0.250000 K\n0.250000 0.388403 0.111597 Au\n0.750000 0.611597 0.888403 Au\n0.750000 0.888403 0.611597 Au\n0.250000 0.111597 0.388403 Au\n0.559479 0.657373 0.342627 S\n0.059480 0.842627 0.157373 S\n0.940520 0.157373 0.842627 S\n0.440520 0.342628 0.657372 S\n0.147947 0.288334 0.005920 S\n0.942200 0.211666 0.494080 S\n0.183630 0.432717 0.780469 S\n0.852052 0.711666 0.994080 S\n0.057799 0.788334 0.505920 S\n0.647947 0.505920 0.788334 S\n0.442201 0.994081 0.711666 S\n0.396815 0.219531 0.567284 S\n0.683630 0.280470 0.932716 S\n0.103185 0.932716 0.280469 S\n0.816369 0.567284 0.219531 S\n0.603184 0.780469 0.432716 S\n0.316370 0.719531 0.067284 S\n0.896815 0.067284 0.719531 S\n0.557799 0.005920 0.288334 S\n0.352053 0.494081 0.211666 S\n",
"nsites": 28,
"nelements": 3,
"elements": [
"K",
"Au",
"S"
],
"chemical_system": "Au-K-S",
"density": 3.792921769338673,
"density_atomic": 0.0403366922482156,
"volume": 694.157067408983,
"volume_molar": 14.929684176734659,
"formula_full": "K4 Au4 S20",
"formula_reduced": "KAuS5",
"formula_anonymous": "ABC5",
"energy_above_hull": 1.405210795714286,
"spacegroup": 72
},
{
"id": "jvasp-116291",
"created_at": "2022-09-04T14:38:40.792874Z",
"updated_at": "2022-09-04T14:38:40.792905Z",
"structure_string": "Li1 Y1 Se1\n1.0\n4.917673 -0.000000 -0.000000\n-2.458836 4.258830 0.000000\n-0.000000 -0.000000 3.654320\nLi Y Se\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.666666 0.333333 0.000000 Y\n0.333333 0.666667 0.000000 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Y",
"Se"
],
"chemical_system": "Li-Se-Y",
"density": 3.792722062045112,
"density_atomic": 0.039198073981230555,
"volume": 76.53437261832067,
"volume_molar": 15.36335882952723,
"formula_full": "Li1 Y1 Se1",
"formula_reduced": "LiYSe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.3263929388888889,
"spacegroup": 187
},
{
"id": "jvasp-37423",
"created_at": "2022-09-04T14:37:57.078315Z",
"updated_at": "2022-09-04T14:37:57.078337Z",
"structure_string": "W2 S2 Cl8\n1.0\n5.965910 0.167321 -1.065265\n1.417494 7.046093 -0.079845\n0.356041 1.623137 7.470708\nW S Cl\n2 2 8\ndirect\n0.850875 0.757848 0.781865 W\n0.149124 0.242152 0.218137 W\n0.613999 0.035328 0.706454 S\n0.386001 -0.035328 0.293547 S\n0.179900 0.832737 0.896129 Cl\n-0.000805 0.738216 0.522054 Cl\n0.804348 0.654258 0.085509 Cl\n0.625197 0.555784 0.710794 Cl\n0.374802 0.444215 0.289208 Cl\n0.195652 0.345741 0.914492 Cl\n0.000804 0.261784 0.477946 Cl\n0.820099 0.167263 0.103872 Cl\n",
"nsites": 12,
"nelements": 3,
"elements": [
"W",
"S",
"Cl"
],
"chemical_system": "Cl-S-W",
"density": 3.792404039623708,
"density_atomic": 0.038306914605622404,
"volume": 313.25937167068867,
"volume_molar": 15.720766921583696,
"formula_full": "W2 S2 Cl8",
"formula_reduced": "WSCl4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.7450827116666667,
"spacegroup": 2
},
{
"id": "jvasp-46829",
"created_at": "2022-09-04T14:38:13.433042Z",
"updated_at": "2022-09-04T14:38:13.433060Z",
"structure_string": "Li3 V6 O3 F15\n1.0\n4.522745 -0.022106 -0.002188\n0.223054 8.547995 0.001609\n0.120203 4.271135 7.468863\nLi V O F\n3 6 3 15\ndirect\n0.500311 0.333011 0.334761 Li\n0.003452 0.000332 0.000182 Li\n0.491686 0.664276 0.667669 Li\n0.515187 0.305155 0.689766 V\n0.513144 0.985894 0.331207 V\n0.986942 0.003836 0.664578 V\n0.514320 0.664895 0.009197 V\n0.986112 0.349278 0.011074 V\n0.985309 0.660092 0.355305 V\n0.746968 0.467234 0.086857 O\n0.738849 0.785256 0.420130 O\n0.760716 0.116864 0.753896 O\n0.259210 0.539251 0.566442 F\n0.731114 0.783943 0.771287 F\n0.739747 0.440696 0.783073 F\n0.234097 0.226866 0.894768 F\n0.250541 0.893331 0.546982 F\n0.739869 0.437928 0.453770 F\n0.268150 0.222421 0.218001 F\n0.263546 0.216653 0.557662 F\n0.260506 0.561764 0.228907 F\n0.769233 0.776845 0.114791 F\n0.748255 0.110434 0.434074 F\n0.253216 0.564063 0.890508 F\n0.759912 0.118676 0.106032 F\n0.237047 0.883728 0.223775 F\n0.242524 0.887260 0.885198 F\n",
"nsites": 27,
"nelements": 4,
"elements": [
"Li",
"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
"density": 3.792265733490388,
"density_atomic": 0.09350482610767548,
"volume": 288.755149054105,
"volume_molar": 6.44045982510593,
"formula_full": "Li3 V6 O3 F15",
"formula_reduced": "LiV2OF5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 1.1289248124999998,
"spacegroup": 1
},
{
"id": "jvasp-90436",
"created_at": "2022-09-04T14:38:17.664261Z",
"updated_at": "2022-09-04T14:38:17.664279Z",
"structure_string": "Cr3 O5\n1.0\n4.910930 0.402765 3.006874\n2.112204 4.268385 3.063028\n0.040293 0.097781 5.203730\nCr O\n3 5\ndirect\n0.848613 0.909471 0.801507 Cr\n0.209727 0.098937 0.158751 Cr\n0.280783 0.350723 0.390456 Cr\n0.107282 0.766992 0.406084 O\n0.468167 0.048864 0.752278 O\n0.974412 0.203877 0.574184 O\n0.570074 -0.012993 0.206526 O\n0.140628 0.534991 0.008734 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cr",
"O"
],
"chemical_system": "Cr-O",
"density": 3.7921579671838157,
"density_atomic": 0.07741807331364571,
"volume": 103.33504384162865,
"volume_molar": 7.778727243188236,
"formula_full": "Cr3 O5",
"formula_reduced": "Cr3O5",
"formula_anonymous": "A3B5",
"energy_above_hull": 3.6270312125,
"spacegroup": 1
}
]
}