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=nelements&page=143",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=141",
"results": [
{
"id": "jvasp-35760",
"created_at": "2022-09-04T14:37:32.184256Z",
"updated_at": "2022-09-04T14:37:32.184291Z",
"structure_string": "Ti1 Au2\n1.0\n3.460545 0.000000 0.000000\n0.000000 3.460545 -0.000000\n-1.730273 -1.730273 4.289883\nTi Au\n1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.664029 0.664029 0.328056 Au\n0.335973 0.335973 0.671943 Au\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ti",
"Au"
],
"chemical_system": "Au-Ti",
"density": 14.28040402871825,
"density_atomic": 0.058396498192355706,
"volume": 51.372943461748704,
"volume_molar": 10.312503226072412,
"formula_full": "Ti1 Au2",
"formula_reduced": "TiAu2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.2339378244444443,
"spacegroup": 139
},
{
"id": "jvasp-35944",
"created_at": "2022-09-04T14:37:27.967645Z",
"updated_at": "2022-09-04T14:37:27.967670Z",
"structure_string": "Lu2 S4\n1.0\n3.798895 0.000000 0.000000\n0.000000 3.798895 0.000000\n0.000000 0.000000 7.762331\nLu S\n2 4\ndirect\n0.499999 0.000000 0.726438 Lu\n0.000000 0.499999 0.273562 Lu\n0.499999 0.000000 0.369229 S\n0.000000 0.499999 0.630771 S\n0.499999 0.499999 0.000000 S\n0.000000 0.000000 0.000000 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Lu",
"S"
],
"chemical_system": "Lu-S",
"density": 7.088371686962619,
"density_atomic": 0.053560486421208954,
"volume": 112.0228810622622,
"volume_molar": 11.243625968294689,
"formula_full": "Lu2 S4",
"formula_reduced": "LuS2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9219785833333334,
"spacegroup": 129
},
{
"id": "jvasp-51417",
"created_at": "2022-09-04T14:37:09.613166Z",
"updated_at": "2022-09-04T14:37:09.613182Z",
"structure_string": "Yb1 H3\n1.0\n2.600890 2.600890 0.000000\n0.000000 2.600890 2.600890\n2.600890 0.000000 2.600890\nYb H\n1 3\ndirect\n0.000000 0.000000 0.000000 Yb\n0.750000 0.750000 0.750000 H\n0.250000 0.250000 0.250000 H\n0.500000 0.500000 0.500000 H\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Yb",
"H"
],
"chemical_system": "H-Yb",
"density": 8.308512307866664,
"density_atomic": 0.11367475871296341,
"volume": 35.18811075816994,
"volume_molar": 5.297693901604243,
"formula_full": "Yb1 H3",
"formula_reduced": "YbH3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.681440175,
"spacegroup": 225
},
{
"id": "jvasp-36417",
"created_at": "2022-09-04T14:37:27.907604Z",
"updated_at": "2022-09-04T14:37:27.907630Z",
"structure_string": "Ta1 C1\n1.0\n2.418388 2.418388 0.000000\n2.418388 -0.000000 -2.418388\n-0.000000 2.418388 -2.418388\nTa C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ta\n0.750001 0.750001 0.750001 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ta",
"C"
],
"chemical_system": "C-Ta",
"density": 11.326748528955006,
"density_atomic": 0.07070043116824591,
"volume": 28.28837062168118,
"volume_molar": 8.51782748774064,
"formula_full": "Ta1 C1",
"formula_reduced": "TaC",
"formula_anonymous": "AB",
"energy_above_hull": 4.172894599999999,
"spacegroup": 216
},
{
"id": "jvasp-103619",
"created_at": "2022-09-04T14:37:07.816416Z",
"updated_at": "2022-09-04T14:37:07.816444Z",
"structure_string": "Na3 Cd1\n1.0\n4.338953 -0.422697 -3.712188\n-1.194268 4.192721 -3.712188\n0.352583 0.422697 5.699345\nNa Cd\n3 1\ndirect\n0.749999 0.250000 0.499999 Na\n0.249999 0.750000 0.500000 Na\n0.499999 0.500000 -0.000001 Na\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"Cd"
],
"chemical_system": "Cd-Na",
"density": 2.6070488851737035,
"density_atomic": 0.034623417607146365,
"volume": 115.52874546891609,
"volume_molar": 17.393259176000623,
"formula_full": "Na3 Cd1",
"formula_reduced": "Na3Cd",
"formula_anonymous": "AB3",
"energy_above_hull": 5.500000000002725e-05,
"spacegroup": 139
},
{
"id": "jvasp-56073",
"created_at": "2022-09-04T14:37:28.672904Z",
"updated_at": "2022-09-04T14:37:28.672930Z",
"structure_string": "Sc2 B4\n1.0\n3.752197 0.000000 2.166332\n1.250733 3.537605 2.166332\n-0.000000 0.000000 4.332663\nSc B\n2 4\ndirect\n0.875001 0.874999 0.874999 Sc\n0.125000 0.125000 0.125000 Sc\n0.500000 -0.000000 0.499999 B\n-0.000000 0.499999 0.500000 B\n0.500000 0.499999 0.499999 B\n0.500000 0.499999 -0.000000 B\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sc",
"B"
],
"chemical_system": "B-Sc",
"density": 3.8446727772516516,
"density_atomic": 0.10432811702814054,
"volume": 57.51086256432303,
"volume_molar": 5.772308493189463,
"formula_full": "Sc2 B4",
"formula_reduced": "ScB2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.438186805555556,
"spacegroup": 227
},
{
"id": "jvasp-20364",
"created_at": "2022-09-04T14:37:31.950775Z",
"updated_at": "2022-09-04T14:37:31.950808Z",
"structure_string": "Ni6 N2\n1.0\n2.310396 -4.001724 0.000000\n2.310396 4.001724 0.000000\n0.000000 -0.000000 4.305634\nNi N\n6 2\ndirect\n0.329542 0.329542 0.499999 Ni\n0.670459 0.670459 0.000000 Ni\n0.329542 0.000000 0.000000 Ni\n0.000001 0.670458 0.499999 Ni\n0.670458 0.000001 0.499999 Ni\n0.000000 0.329542 0.000000 Ni\n0.666668 0.333334 0.749999 N\n0.333334 0.666668 0.250000 N\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ni",
"N"
],
"chemical_system": "N-Ni",
"density": 7.929222776052353,
"density_atomic": 0.10048224405003589,
"volume": 79.61605630559305,
"volume_molar": 5.993238722854587,
"formula_full": "Ni6 N2",
"formula_reduced": "Ni3N",
"formula_anonymous": "AB3",
"energy_above_hull": 2.0587026125,
"spacegroup": 182
},
{
"id": "jvasp-34192",
"created_at": "2022-09-04T14:37:15.018428Z",
"updated_at": "2022-09-04T14:37:15.018458Z",
"structure_string": "Tb4 O6\n1.0\n5.368454 0.000000 0.000000\n0.000000 5.368454 0.000000\n0.000000 -0.000000 5.368205\nTb O\n4 6\ndirect\n0.250000 0.749999 0.749999 Tb\n0.749999 0.749999 0.250000 Tb\n0.250000 0.250000 0.250000 Tb\n0.749999 0.250000 0.749999 Tb\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Tb",
"O"
],
"chemical_system": "O-Tb",
"density": 7.853319784174081,
"density_atomic": 0.06463569685453867,
"volume": 154.71326970458443,
"volume_molar": 9.31705087600851,
"formula_full": "Tb4 O6",
"formula_reduced": "Tb2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.48497146,
"spacegroup": 224
},
{
"id": "jvasp-78282",
"created_at": "2022-09-04T14:37:09.674605Z",
"updated_at": "2022-09-04T14:37:09.674621Z",
"structure_string": "La1 Te1\n1.0\n3.936291 -0.000000 -0.000000\n-0.000000 3.936291 -0.000000\n0.000000 0.000000 3.936291\nLa Te\n1 1\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"La",
"Te"
],
"chemical_system": "La-Te",
"density": 7.255939168322263,
"density_atomic": 0.032792037651410685,
"volume": 60.990415455745904,
"volume_molar": 18.36464334426907,
"formula_full": "La1 Te1",
"formula_reduced": "LaTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.1732663833333332,
"spacegroup": 221
},
{
"id": "jvasp-8042",
"created_at": "2022-09-04T14:37:09.676263Z",
"updated_at": "2022-09-04T14:37:09.676294Z",
"structure_string": "Ni3 S2\n1.0\n4.072424 -0.024002 0.063217\n0.061870 4.072024 0.063217\n-0.024513 -0.024002 4.072840\nNi S\n3 2\ndirect\n0.244469 0.755531 0.500001 Ni\n0.500000 0.244470 0.755531 Ni\n0.755530 0.500000 0.244470 Ni\n0.253306 0.253306 0.253306 S\n0.746694 0.746694 0.746695 S\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Ni",
"S"
],
"chemical_system": "Ni-S",
"density": 5.904199944917766,
"density_atomic": 0.07401001946579788,
"volume": 67.5584202799817,
"volume_molar": 8.13692632898577,
"formula_full": "Ni3 S2",
"formula_reduced": "Ni3S2",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.38785544,
"spacegroup": 155
},
{
"id": "jvasp-18066",
"created_at": "2022-09-04T14:37:28.439721Z",
"updated_at": "2022-09-04T14:37:28.439743Z",
"structure_string": "Th1 Pb3\n1.0\n4.911337 -0.000000 -0.000000\n0.000000 4.911337 -0.000000\n0.000000 0.000000 4.911337\nTh Pb\n1 3\ndirect\n0.000000 0.000000 0.000000 Th\n0.000000 0.500000 0.500000 Pb\n0.500000 0.500000 0.000000 Pb\n0.500000 0.000000 0.500000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Th",
"Pb"
],
"chemical_system": "Pb-Th",
"density": 11.965301944599787,
"density_atomic": 0.03376453602417067,
"volume": 118.46749492238132,
"volume_molar": 17.835698247679137,
"formula_full": "Th1 Pb3",
"formula_reduced": "ThPb3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.967949515,
"spacegroup": 221
},
{
"id": "jvasp-36393",
"created_at": "2022-09-04T14:37:27.906935Z",
"updated_at": "2022-09-04T14:37:27.906957Z",
"structure_string": "Sc1 Si1\n1.0\n3.088834 3.088834 -0.000000\n3.088834 -0.000000 -3.088834\n0.000000 3.088834 -3.088834\nSc Si\n1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.749999 0.749999 0.749999 Si\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sc",
"Si"
],
"chemical_system": "Sc-Si",
"density": 2.05780659477842,
"density_atomic": 0.03393253398467838,
"volume": 58.94048469539775,
"volume_molar": 17.74739476491555,
"formula_full": "Sc1 Si1",
"formula_reduced": "ScSi",
"formula_anonymous": "AB",
"energy_above_hull": 2.123601925,
"spacegroup": 216
}
]
}