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=-structure_string&page=676",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-structure_string&page=674",
"results": [
{
"id": "jvasp-100795",
"created_at": "2022-09-04T14:36:55.202703Z",
"updated_at": "2022-09-04T14:36:55.202731Z",
"structure_string": "Th2 C1 N1\n1.0\n3.584668 -0.001638 5.365259\n1.626212 3.194571 5.365259\n-0.002673 -0.001638 6.452584\nTh C N\n2 1 1\ndirect\n0.249581 0.249580 0.249580 Th\n0.750420 0.750418 0.750419 Th\n0.000000 0.000000 0.000000 C\n0.500001 0.499999 0.500000 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Th",
"C",
"N"
],
"chemical_system": "C-N-Th",
"density": 11.001744922223503,
"density_atomic": 0.05407462359440392,
"volume": 73.9718510109787,
"volume_molar": 11.136722476646552,
"formula_full": "Th2 C1 N1",
"formula_reduced": "Th2CN",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.2006436125,
"spacegroup": 166
},
{
"id": "jvasp-12501",
"created_at": "2022-09-04T14:37:33.802675Z",
"updated_at": "2022-09-04T14:37:33.802711Z",
"structure_string": "Th2 Br8\n1.0\n7.199343 -0.020949 -2.124277\n-4.028230 5.966938 -2.124277\n0.011172 0.020949 7.506196\nTh Br\n2 8\ndirect\n0.874999 0.125000 0.750000 Th\n0.125000 0.875000 0.250000 Th\n0.203204 0.266226 0.563021 Br\n0.640183 0.203204 0.436979 Br\n0.359816 0.796796 0.563021 Br\n0.796795 0.733774 0.436979 Br\n0.796795 0.359816 0.063020 Br\n0.733774 0.796796 0.936979 Br\n0.203204 0.640184 0.936979 Br\n0.266226 0.203204 0.063021 Br\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Th",
"Br"
],
"chemical_system": "Br-Th",
"density": 5.681596822778205,
"density_atomic": 0.03101162331712308,
"volume": 322.4597402638544,
"volume_molar": 19.41897945301971,
"formula_full": "Th2 Br8",
"formula_reduced": "ThBr4",
"formula_anonymous": "AB4",
"energy_above_hull": 0.2866684039999998,
"spacegroup": 141
},
{
"id": "jvasp-56453",
"created_at": "2022-09-04T14:37:32.764335Z",
"updated_at": "2022-09-04T14:37:32.764354Z",
"structure_string": "Th2 Br8\n1.0\n6.945472 2.878225 -3.660800\n-1.480133 7.371089 -3.660800\n-1.534783 -2.878224 7.699706\nTh Br\n2 8\ndirect\n0.375000 0.125000 0.250000 Th\n0.625001 0.875001 0.750001 Th\n0.676101 0.538716 0.813440 Br\n0.362661 0.176101 0.637386 Br\n0.323900 0.461285 0.186561 Br\n0.961285 0.274725 0.137385 Br\n0.038716 0.725277 0.862616 Br\n0.774724 0.137340 0.313440 Br\n0.637340 0.823901 0.362616 Br\n0.225277 0.862661 0.686562 Br\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Th",
"Br"
],
"chemical_system": "Br-Th",
"density": 5.853812464390227,
"density_atomic": 0.03195162078149388,
"volume": 312.97316866604524,
"volume_molar": 18.84768475810146,
"formula_full": "Th2 Br8",
"formula_reduced": "ThBr4",
"formula_anonymous": "AB4",
"energy_above_hull": 0.2837184039999998,
"spacegroup": 88
},
{
"id": "jvasp-3939",
"created_at": "2022-09-04T14:36:41.001899Z",
"updated_at": "2022-09-04T14:36:41.001926Z",
"structure_string": "Th2 Br2 N2\n1.0\n4.125930 0.000000 0.000000\n0.000000 4.125930 0.000000\n0.000000 0.000000 7.553642\nTh Br N\n2 2 2\ndirect\n0.000000 0.500000 0.847705 Th\n0.500000 0.000000 0.152295 Th\n0.500000 0.000000 0.631330 Br\n0.000000 0.500000 0.368670 Br\n0.000000 0.000000 0.000000 N\n0.500000 0.500000 0.000000 N\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Th",
"Br",
"N"
],
"chemical_system": "Br-N-Th",
"density": 8.418375964517457,
"density_atomic": 0.046660688366887394,
"volume": 128.58790150764,
"volume_molar": 12.906240715200404,
"formula_full": "Th2 Br2 N2",
"formula_reduced": "ThBrN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7891743183333333,
"spacegroup": 129
},
{
"id": "jvasp-54938",
"created_at": "2022-09-04T14:38:32.377994Z",
"updated_at": "2022-09-04T14:38:32.378019Z",
"structure_string": "Th2 Bi4\n1.0\n4.558842 0.000000 0.000000\n0.000000 4.558842 -0.000000\n-0.000000 0.000000 9.401835\nTh Bi\n2 4\ndirect\n0.500000 0.000000 0.722150 Th\n0.000000 0.500000 0.277849 Th\n0.000000 0.000000 0.000000 Bi\n0.500000 0.000000 0.364037 Bi\n0.000000 0.500000 0.635962 Bi\n0.500000 0.500000 0.000000 Bi\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Th",
"Bi"
],
"chemical_system": "Bi-Th",
"density": 11.047651896889807,
"density_atomic": 0.030706445306785436,
"volume": 195.3987164601607,
"volume_molar": 19.611976247440275,
"formula_full": "Th2 Bi4",
"formula_reduced": "ThBi2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3413714000000003,
"spacegroup": 129
},
{
"id": "jvasp-35104",
"created_at": "2022-09-04T14:37:37.673287Z",
"updated_at": "2022-09-04T14:37:37.673308Z",
"structure_string": "Th2 Bi2 Te2\n1.0\n4.535511 0.000000 0.000000\n0.000000 4.535511 -0.000000\n0.000000 0.000000 9.257750\nTh Bi Te\n2 2 2\ndirect\n0.500000 0.000000 0.724166 Th\n0.000000 0.500000 0.275834 Th\n0.500000 0.500000 0.000000 Bi\n0.000000 0.000000 0.000000 Bi\n0.500000 0.000000 0.367832 Te\n0.000000 0.500000 0.632168 Te\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Th",
"Bi",
"Te"
],
"chemical_system": "Bi-Te-Th",
"density": 9.916128591673584,
"density_atomic": 0.03150600608039822,
"volume": 190.4398794531104,
"volume_molar": 19.11426267306771,
"formula_full": "Th2 Bi2 Te2",
"formula_reduced": "ThBiTe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2211258888888892,
"spacegroup": 129
},
{
"id": "jvasp-41410",
"created_at": "2022-09-04T14:38:08.940969Z",
"updated_at": "2022-09-04T14:38:08.941002Z",
"structure_string": "Th2 Bi1 Te1\n1.0\n0.000000 3.907416 3.907416\n3.907416 -0.000000 3.907416\n3.907416 3.907416 -0.000000\nTh Bi Te\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Th\n0.500001 0.500001 0.500001 Th\n0.250001 0.250001 0.250001 Bi\n0.750001 0.750001 0.750001 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Th",
"Bi",
"Te"
],
"chemical_system": "Bi-Te-Th",
"density": 11.14285283734634,
"density_atomic": 0.033524402338048626,
"volume": 119.31607190682674,
"volume_molar": 17.963454498829805,
"formula_full": "Th2 Bi1 Te1",
"formula_reduced": "Th2BiTe",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9211033166666671,
"spacegroup": 225
},
{
"id": "jvasp-92357",
"created_at": "2022-09-04T14:35:54.290751Z",
"updated_at": "2022-09-04T14:35:54.290772Z",
"structure_string": "Th2 Bi1 N2\n1.0\n3.935264 0.000000 -1.127996\n-0.323326 3.921959 -1.127996\n0.046461 0.050448 7.590605\nTh Bi N\n2 1 2\ndirect\n0.331951 0.331952 0.663903 Th\n0.668047 0.668049 0.336097 Th\n0.000000 0.000000 0.000000 Bi\n0.749999 0.250000 0.500000 N\n0.249999 0.750000 0.500000 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Th",
"Bi",
"N"
],
"chemical_system": "Bi-N-Th",
"density": 9.899197079789893,
"density_atomic": 0.0425166995084293,
"volume": 117.60084996740416,
"volume_molar": 14.164177439986984,
"formula_full": "Th2 Bi1 N2",
"formula_reduced": "Th2BiN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.4958344,
"spacegroup": 139
},
{
"id": "jvasp-20168",
"created_at": "2022-09-04T14:37:31.659741Z",
"updated_at": "2022-09-04T14:37:31.659764Z",
"structure_string": "Th2 Be26\n1.0\n6.341315 -0.000000 3.661160\n2.113771 5.978649 3.661160\n-0.000000 0.000000 7.322319\nTh Be\n2 26\ndirect\n0.750000 0.750000 0.750000 Th\n0.250000 0.250000 0.250000 Th\n0.062492 0.287072 0.712928 Be\n0.712929 0.937508 0.062492 Be\n0.937508 0.712928 0.287071 Be\n0.212928 0.562492 0.437508 Be\n0.562493 0.437508 0.212928 Be\n0.437508 0.212928 0.562492 Be\n0.212928 0.437508 0.787072 Be\n0.212928 0.787072 0.562492 Be\n0.787072 0.437508 0.562492 Be\n0.287072 0.712928 0.062492 Be\n0.287072 0.937508 0.712928 Be\n0.937509 0.062492 0.712928 Be\n0.000000 0.000000 0.000000 Be\n0.712929 0.287072 0.937508 Be\n0.062492 0.937508 0.287072 Be\n0.937508 0.287072 0.062492 Be\n0.787072 0.562492 0.212928 Be\n0.562492 0.787072 0.437508 Be\n0.562493 0.212928 0.787072 Be\n0.437508 0.787072 0.212928 Be\n0.787072 0.212928 0.437508 Be\n0.437508 0.562492 0.787072 Be\n0.287072 0.062492 0.937508 Be\n0.500000 0.500000 0.500000 Be\n0.062492 0.712928 0.937508 Be\n0.712929 0.062492 0.287071 Be\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Th",
"Be"
],
"chemical_system": "Be-Th",
"density": 4.177513421297504,
"density_atomic": 0.1008618667876954,
"volume": 277.6073940703212,
"volume_molar": 5.97068143967237,
"formula_full": "Th2 Be26",
"formula_reduced": "ThBe13",
"formula_anonymous": "AB13",
"energy_above_hull": 2.396351064285714,
"spacegroup": 226
},
{
"id": "jvasp-112559",
"created_at": "2022-09-04T14:38:42.182878Z",
"updated_at": "2022-09-04T14:38:42.182906Z",
"structure_string": "Th2 B8 O16\n1.0\n7.645317 -0.005614 3.378387\n6.482821 4.052645 3.378387\n-0.016916 -0.004846 7.326590\nTh B O\n2 8 16\ndirect\n0.192642 0.807357 0.750001 Th\n0.807357 0.192644 0.250000 Th\n0.452724 0.829556 0.008693 B\n0.547275 0.170445 0.991307 B\n0.829554 0.452726 0.508693 B\n0.170445 0.547276 0.491307 B\n0.000437 0.607650 0.203539 B\n0.607649 0.000437 0.703539 B\n0.999562 0.392351 0.796462 B\n0.392349 0.999564 0.296462 B\n0.935447 0.329215 0.703782 O\n0.708725 0.187468 0.986911 O\n0.812532 0.291275 0.513090 O\n0.329213 0.935448 0.203782 O\n0.064552 0.670786 0.296219 O\n0.670785 0.064553 0.796219 O\n0.506509 0.808332 0.491053 O\n0.070589 0.361724 0.332804 O\n0.493490 0.191669 0.508948 O\n0.808330 0.506510 0.991053 O\n0.638275 0.929412 0.167197 O\n0.187467 0.708726 0.486911 O\n0.361724 0.070589 0.832804 O\n0.929410 0.638277 0.667197 O\n0.191668 0.493491 0.008948 O\n0.291274 0.812533 0.013090 O\n",
"nsites": 26,
"nelements": 3,
"elements": [
"Th",
"B",
"O"
],
"chemical_system": "B-O-Th",
"density": 5.886508176629275,
"density_atomic": 0.11427422187862483,
"volume": 227.52287937357934,
"volume_molar": 5.269903098877675,
"formula_full": "Th2 B8 O16",
"formula_reduced": "Th(BO2)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 3.607457225641026,
"spacegroup": 15
},
{
"id": "jvasp-21065",
"created_at": "2022-09-04T14:37:55.965701Z",
"updated_at": "2022-09-04T14:37:55.965723Z",
"structure_string": "Th2 B8 Mo2\n1.0\n3.806446 0.000000 0.000000\n0.000000 5.917201 -1.516340\n0.000000 0.020478 6.108366\nTh B Mo\n2 8 2\ndirect\n0.000000 0.698114 0.301886 Th\n0.000000 0.301886 0.698114 Th\n0.500000 0.910336 0.089664 B\n0.500000 0.089664 0.910337 B\n0.500000 0.628962 0.628962 B\n0.500000 0.371039 0.371039 B\n0.500000 0.376741 0.064844 B\n0.500000 0.623259 0.935157 B\n0.500000 0.064844 0.376741 B\n0.500000 0.935156 0.623259 B\n0.000000 0.828319 0.828319 Mo\n0.000000 0.171682 0.171682 Mo\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Th",
"B",
"Mo"
],
"chemical_system": "B-Mo-Th",
"density": 8.953212285346225,
"density_atomic": 0.08714596000326436,
"volume": 137.7000150041436,
"volume_molar": 6.91040727507554,
"formula_full": "Th2 B8 Mo2",
"formula_reduced": "ThB4Mo",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.946335305555556,
"spacegroup": 65
},
{
"id": "jvasp-41375",
"created_at": "2022-09-04T14:37:38.360945Z",
"updated_at": "2022-09-04T14:37:38.360964Z",
"structure_string": "Th2 Au6\n1.0\n3.269710 -5.663304 -0.000000\n3.269710 5.663304 0.000000\n-0.000000 -0.000000 4.775946\nTh Au\n2 6\ndirect\n0.333333 0.666667 0.750001 Th\n0.666667 0.333333 0.250000 Th\n0.156134 0.312268 0.250000 Au\n0.687732 0.843866 0.250000 Au\n0.156134 0.843866 0.250000 Au\n0.843866 0.687732 0.750001 Au\n0.312268 0.156134 0.750001 Au\n0.843866 0.156134 0.750001 Au\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Th",
"Au"
],
"chemical_system": "Au-Th",
"density": 15.451746456207639,
"density_atomic": 0.04522946735984257,
"volume": 176.87583929194975,
"volume_molar": 13.314640015740752,
"formula_full": "Th2 Au6",
"formula_reduced": "ThAu3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9885095775,
"spacegroup": 194
}
]
}