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=elements&page=643",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=elements&page=641",
"results": [
{
"id": "jvasp-69",
"created_at": "2022-09-04T14:37:12.057534Z",
"updated_at": "2022-09-04T14:37:12.057556Z",
"structure_string": "Nb2 Se4\n1.0\n1.745987 -3.024137 0.000000\n1.745987 3.024137 0.000000\n0.000000 0.000000 12.678071\nNb Se\n2 4\ndirect\n0.000000 0.000000 0.250000 Nb\n0.000000 0.000000 0.750000 Nb\n0.333334 0.666668 0.882574 Se\n0.666668 0.333334 0.382574 Se\n0.333334 0.666668 0.617426 Se\n0.666668 0.333334 0.117426 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nb",
"Se"
],
"chemical_system": "Nb-Se",
"density": 6.221952061606606,
"density_atomic": 0.0448152277243516,
"volume": 133.8830639644331,
"volume_molar": 13.437710942898331,
"formula_full": "Nb2 Se4",
"formula_reduced": "NbSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.160592044444445,
"spacegroup": 194
},
{
"id": "jvasp-583",
"created_at": "2022-09-04T14:37:27.598139Z",
"updated_at": "2022-09-04T14:37:27.598166Z",
"structure_string": "Nb8 Se16\n1.0\n3.490632 -6.045952 0.000000\n3.490632 6.045952 0.000000\n0.000000 0.000000 12.691637\nNb Se\n8 16\ndirect\n0.000210 0.500105 0.250000 Nb\n0.999789 0.499895 0.750000 Nb\n0.500105 0.000210 0.750000 Nb\n0.499895 0.500105 0.250000 Nb\n0.500105 0.499895 0.750000 Nb\n0.000000 0.000000 0.250000 Nb\n0.499895 0.999789 0.250000 Nb\n0.000000 0.000000 0.750000 Nb\n0.166652 0.833347 0.382548 Se\n0.833347 0.166652 0.882548 Se\n0.333333 0.666667 0.617562 Se\n0.333333 0.666667 0.882438 Se\n0.333306 0.166652 0.882548 Se\n0.666667 0.333333 0.382438 Se\n0.166652 0.333306 0.382548 Se\n0.833347 0.166652 0.617452 Se\n0.166652 0.333306 0.117452 Se\n0.833347 0.666694 0.617452 Se\n0.166652 0.833347 0.117452 Se\n0.833347 0.666694 0.882548 Se\n0.666694 0.833347 0.382548 Se\n0.666694 0.833347 0.117452 Se\n0.333306 0.166652 0.617452 Se\n0.666667 0.333333 0.117562 Se\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Nb",
"Se"
],
"chemical_system": "Nb-Se",
"density": 6.2200789392743046,
"density_atomic": 0.04480173607365315,
"volume": 535.6935267094223,
"volume_molar": 13.441757591937336,
"formula_full": "Nb8 Se16",
"formula_reduced": "NbSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.160515377777778,
"spacegroup": 194
},
{
"id": "jvasp-20623",
"created_at": "2022-09-04T14:38:09.076663Z",
"updated_at": "2022-09-04T14:38:09.076687Z",
"structure_string": "Nb2 Se4\n1.0\n1.746048 -3.024243 -0.000000\n1.746048 3.024243 0.000000\n0.000000 0.000000 12.676821\nNb Se\n2 4\ndirect\n0.000000 0.000000 0.250000 Nb\n0.000000 0.000000 0.750000 Nb\n0.333334 0.666667 0.882584 Se\n0.666667 0.333334 0.382584 Se\n0.333334 0.666667 0.617416 Se\n0.666667 0.333334 0.117416 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nb",
"Se"
],
"chemical_system": "Nb-Se",
"density": 6.222130092527351,
"density_atomic": 0.04481651003835468,
"volume": 133.87923323045692,
"volume_molar": 13.437326455911354,
"formula_full": "Nb2 Se4",
"formula_reduced": "NbSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.160592044444445,
"spacegroup": 194
},
{
"id": "jvasp-581",
"created_at": "2022-09-04T14:37:57.993952Z",
"updated_at": "2022-09-04T14:37:57.993979Z",
"structure_string": "Nb1 Se2\n1.0\n1.752717 -3.035794 0.000000\n1.752717 3.035794 0.000000\n0.000000 0.000000 6.316721\nNb Se\n1 2\ndirect\n0.000000 0.000000 0.000000 Nb\n0.666668 0.333334 0.264772 Se\n0.333334 0.666668 0.735228 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Nb",
"Se"
],
"chemical_system": "Nb-Se",
"density": 6.196072911997788,
"density_atomic": 0.04462882641949611,
"volume": 67.22112680716717,
"volume_molar": 13.493836255952337,
"formula_full": "Nb1 Se2",
"formula_reduced": "NbSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.169362044444445,
"spacegroup": 164
},
{
"id": "jvasp-27287",
"created_at": "2022-09-04T14:38:35.467246Z",
"updated_at": "2022-09-04T14:38:35.467273Z",
"structure_string": "Nb4 Se18\n1.0\n8.246479 0.161954 0.166333\n-0.467846 8.380793 0.131305\n-0.757189 -1.428466 8.329087\nNb Se\n4 18\ndirect\n0.088904 0.098578 0.137823 Nb\n0.911096 0.901421 0.862177 Nb\n0.415676 0.361978 0.397356 Nb\n0.584323 0.638021 0.602643 Nb\n0.096727 0.407258 0.305401 Se\n0.903272 0.592740 0.694598 Se\n0.810901 0.184113 0.003073 Se\n0.189099 0.815886 0.996927 Se\n0.426483 0.661126 0.323609 Se\n0.573517 0.338873 0.676390 Se\n0.733989 0.926689 0.585436 Se\n0.266010 0.073309 0.414564 Se\n0.960807 0.804795 0.148106 Se\n0.553652 0.092706 0.280735 Se\n0.391822 0.212484 0.084134 Se\n0.608177 0.787515 0.915866 Se\n0.670022 0.524109 0.309034 Se\n0.329978 0.475889 0.690965 Se\n0.031481 0.808740 0.582762 Se\n0.968518 0.191258 0.417238 Se\n0.039192 0.195203 0.851894 Se\n0.446348 0.907292 0.719265 Se\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Nb",
"Se"
],
"chemical_system": "Nb-Se",
"density": 5.142230265517087,
"density_atomic": 0.03799860902762512,
"volume": 578.9685612967023,
"volume_molar": 15.848318962470135,
"formula_full": "Nb4 Se18",
"formula_reduced": "Nb2Se9",
"formula_anonymous": "A2B9",
"energy_above_hull": 2.541401736363636,
"spacegroup": 2
},
{
"id": "jvasp-15937",
"created_at": "2022-09-04T14:38:29.049742Z",
"updated_at": "2022-09-04T14:38:29.049762Z",
"structure_string": "Nb1 Se2\n1.0\n1.752654 -3.035685 -0.000000\n1.752654 3.035685 0.000000\n-0.000000 0.000000 6.315867\nNb Se\n1 2\ndirect\n0.000000 0.000000 0.000000 Nb\n0.666666 0.333332 0.264822 Se\n0.333332 0.666666 0.735178 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Nb",
"Se"
],
"chemical_system": "Nb-Se",
"density": 6.197355980699048,
"density_atomic": 0.04463806805547523,
"volume": 67.20720969087785,
"volume_molar": 13.491042561510083,
"formula_full": "Nb1 Se2",
"formula_reduced": "NbSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.1693587111111112,
"spacegroup": 164
},
{
"id": "jvasp-31795",
"created_at": "2022-09-04T14:38:31.604550Z",
"updated_at": "2022-09-04T14:38:31.604573Z",
"structure_string": "Nb2 Se4\n1.0\n-1.563082 3.118637 -0.000000\n0.000001 0.000002 -13.017930\n-1.919309 -2.912985 0.000001\nNb Se\n2 4\ndirect\n0.333593 0.750000 0.666154 Nb\n0.666406 0.250000 0.333842 Nb\n0.333085 0.379345 0.667166 Se\n0.666914 0.879344 0.332837 Se\n0.666914 0.620655 0.332837 Se\n0.333085 0.120656 0.667165 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nb",
"Se"
],
"chemical_system": "Nb-Se",
"density": 6.071788481719865,
"density_atomic": 0.04373363549061289,
"volume": 137.1941740651279,
"volume_molar": 13.770043794535693,
"formula_full": "Nb2 Se4",
"formula_reduced": "NbSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.163332044444445,
"spacegroup": 194
},
{
"id": "jvasp-90289",
"created_at": "2022-09-04T14:36:02.660612Z",
"updated_at": "2022-09-04T14:36:02.660643Z",
"structure_string": "Nb5 Se4\n1.0\n3.372594 -0.000000 0.834204\n1.686296 7.068055 0.417102\n-0.010826 0.000000 7.278383\nNb Se\n5 4\ndirect\n0.694386 0.932550 0.678675 Nb\n0.373061 0.321324 0.932550 Nb\n0.626938 0.678675 0.067449 Nb\n0.305613 0.067449 0.321324 Nb\n0.000000 0.000000 0.000000 Nb\n0.942463 0.774570 0.340501 Se\n0.282965 0.659497 0.774570 Se\n0.717034 0.340502 0.225429 Se\n0.057536 0.225429 0.659498 Se\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Nb",
"Se"
],
"chemical_system": "Nb-Se",
"density": 7.466070386428174,
"density_atomic": 0.05185419173346489,
"volume": 173.56359629055243,
"volume_molar": 11.613604529705784,
"formula_full": "Nb5 Se4",
"formula_reduced": "Nb5Se4",
"formula_anonymous": "A4B5",
"energy_above_hull": 4.268942274074074,
"spacegroup": 87
},
{
"id": "jvasp-29909",
"created_at": "2022-09-04T14:37:06.635483Z",
"updated_at": "2022-09-04T14:37:06.635505Z",
"structure_string": "Nb4 Se8\n1.0\n3.497166 0.000000 0.000000\n-1.748583 3.028638 0.000000\n0.000000 0.000000 25.476342\nNb Se\n4 8\ndirect\n0.000000 0.000001 0.500000 Nb\n0.333338 0.666672 0.000000 Nb\n-0.000010 -0.000020 0.747086 Nb\n-0.000010 -0.000020 0.252914 Nb\n0.000008 0.000017 0.934089 Se\n0.000008 0.000017 0.065911 Se\n0.333329 0.666656 0.681455 Se\n0.333329 0.666656 0.318545 Se\n0.666683 0.333365 0.813024 Se\n0.666683 0.333365 0.186976 Se\n0.666674 0.333348 0.565805 Se\n0.666674 0.333348 0.434194 Se\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Nb",
"Se"
],
"chemical_system": "Nb-Se",
"density": 6.174213091277457,
"density_atomic": 0.04447137537617479,
"volume": 269.83649366574144,
"volume_molar": 13.54161122533286,
"formula_full": "Nb4 Se8",
"formula_reduced": "NbSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.1644220444444446,
"spacegroup": 187
},
{
"id": "jvasp-98688",
"created_at": "2022-09-04T14:35:42.835822Z",
"updated_at": "2022-09-04T14:35:42.835849Z",
"structure_string": "Nb24 Si8\n1.0\n5.221230 0.000000 0.000000\n0.000000 10.283564 0.000000\n0.000000 -0.000000 10.283564\nNb Si\n24 8\ndirect\n0.476254 0.603409 0.765953 Nb\n0.216662 0.153095 0.834815 Nb\n0.716662 0.334815 0.846904 Nb\n0.283338 0.834815 0.346905 Nb\n0.783338 0.653095 0.334815 Nb\n0.783338 0.846904 0.165185 Nb\n0.283338 0.665185 0.153095 Nb\n0.764008 0.560097 0.036748 Nb\n0.264008 0.963252 0.060097 Nb\n0.264008 0.536747 0.439903 Nb\n0.764008 0.939903 0.463252 Nb\n0.235992 0.439903 0.963252 Nb\n0.735992 0.036748 0.939903 Nb\n0.735992 0.463252 0.560097 Nb\n0.235992 0.060097 0.536747 Nb\n0.716662 0.165185 0.653095 Nb\n0.976254 0.234047 0.103409 Nb\n0.976254 0.265953 0.396591 Nb\n0.476254 0.896591 0.734047 Nb\n0.523746 0.396591 0.234047 Nb\n0.023746 0.765953 0.896591 Nb\n0.023746 0.734047 0.603409 Nb\n0.523746 0.103409 0.265953 Nb\n0.216662 0.346905 0.665185 Nb\n0.029140 0.044638 0.277477 Si\n0.529140 0.722523 0.544638 Si\n0.529140 0.777477 0.955362 Si\n0.029140 0.455362 0.222523 Si\n0.970860 0.955362 0.722523 Si\n0.470860 0.277477 0.455362 Si\n0.470860 0.222523 0.044638 Si\n0.970860 0.544638 0.777477 Si\n",
"nsites": 32,
"nelements": 2,
"elements": [
"Nb",
"Si"
],
"chemical_system": "Nb-Si",
"density": 7.381436239409816,
"density_atomic": 0.05795485760587278,
"volume": 552.1538887666479,
"volume_molar": 10.391088872919175,
"formula_full": "Nb24 Si8",
"formula_reduced": "Nb3Si",
"formula_anonymous": "AB3",
"energy_above_hull": 4.7988667,
"spacegroup": 86
},
{
"id": "jvasp-14569",
"created_at": "2022-09-04T14:36:33.783602Z",
"updated_at": "2022-09-04T14:36:33.783621Z",
"structure_string": "Nb3 Si6\n1.0\n2.427556 -4.204652 0.000000\n2.427556 4.204652 -0.000000\n0.000000 0.000000 6.656481\nNb Si\n3 6\ndirect\n0.500001 0.500001 0.333333 Nb\n0.500000 0.000001 0.000000 Nb\n0.000001 0.500000 0.666667 Nb\n0.319017 0.159509 0.666667 Si\n0.159509 0.319017 0.000000 Si\n0.159509 0.840492 0.333333 Si\n0.680984 0.840493 0.666667 Si\n0.840493 0.680984 0.000000 Si\n0.840492 0.159509 0.333333 Si\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Nb",
"Si"
],
"chemical_system": "Nb-Si",
"density": 5.465225639297606,
"density_atomic": 0.06623209657236728,
"volume": 135.88577843321502,
"volume_molar": 9.092480944522144,
"formula_full": "Nb3 Si6",
"formula_reduced": "NbSi2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.3395422000000003,
"spacegroup": 180
},
{
"id": "jvasp-19588",
"created_at": "2022-09-04T14:37:54.105485Z",
"updated_at": "2022-09-04T14:37:54.105507Z",
"structure_string": "Nb3 Si1\n1.0\n4.090852 -0.000000 -0.000000\n-0.000000 4.090852 0.000000\n-0.000000 -0.000000 4.090852\nNb Si\n3 1\ndirect\n0.000000 0.500000 0.500000 Nb\n0.500000 0.500000 0.000000 Nb\n0.500000 0.000000 0.500000 Nb\n0.000000 0.000000 0.000000 Si\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Nb",
"Si"
],
"chemical_system": "Nb-Si",
"density": 7.441658181342927,
"density_atomic": 0.058427686193194106,
"volume": 68.46069493106054,
"volume_molar": 10.306998535056628,
"formula_full": "Nb3 Si1",
"formula_reduced": "Nb3Si",
"formula_anonymous": "AB3",
"energy_above_hull": 4.8478792,
"spacegroup": 221
}
]
}