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=1099",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=1097",
"results": [
{
"id": "jvasp-31167",
"created_at": "2022-09-04T14:37:47.605781Z",
"updated_at": "2022-09-04T14:37:47.605814Z",
"structure_string": "Sn1 Hg1 F6\n1.0\n5.920451 0.061030 0.041335\n3.542319 4.744201 0.041335\n3.542319 1.798804 4.390155\nSn Hg F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 Sn\n0.500001 0.500000 0.499998 Hg\n0.059426 0.395228 0.774923 F\n0.395229 0.774925 0.059424 F\n0.774925 0.059425 0.395227 F\n0.225077 0.940575 0.604770 F\n0.604773 0.225076 0.940573 F\n0.940576 0.604772 0.225074 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sn",
"Hg",
"F"
],
"chemical_system": "F-Hg-Sn",
"density": 5.921862817315533,
"density_atomic": 0.06584459730349548,
"volume": 121.49819920874972,
"volume_molar": 9.145990721520144,
"formula_full": "Sn1 Hg1 F6",
"formula_reduced": "SnHgF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-39832",
"created_at": "2022-09-04T14:37:47.609720Z",
"updated_at": "2022-09-04T14:37:47.609738Z",
"structure_string": "Yb2 Hg1 Pb1\n1.0\n-0.000000 3.772278 3.772278\n3.772278 0.000000 3.772278\n3.772278 3.772278 0.000000\nYb Hg Pb\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Yb\n0.499999 0.499999 0.499999 Yb\n0.250000 0.250000 0.250000 Hg\n0.749999 0.749999 0.749999 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Hg",
"Pb"
],
"chemical_system": "Hg-Pb-Yb",
"density": 11.660159479644,
"density_atomic": 0.0372579472294856,
"volume": 107.35964532244645,
"volume_molar": 16.163372401886203,
"formula_full": "Yb2 Hg1 Pb1",
"formula_reduced": "Yb2HgPb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-40283",
"created_at": "2022-09-04T14:37:47.611678Z",
"updated_at": "2022-09-04T14:37:47.611697Z",
"structure_string": "Sr1 Li2 Pb1\n1.0\n-0.000000 3.601765 3.601765\n3.601765 -0.000000 3.601765\n3.601765 3.601765 -0.000000\nSr Li Pb\n1 2 1\ndirect\n0.750001 0.750001 0.750001 Sr\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.249999 0.249999 0.249999 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Li",
"Pb"
],
"chemical_system": "Li-Pb-Sr",
"density": 5.485452066389429,
"density_atomic": 0.042803952663015996,
"volume": 93.44931369985675,
"volume_molar": 14.069123025648343,
"formula_full": "Sr1 Li2 Pb1",
"formula_reduced": "SrLi2Pb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1564417825,
"spacegroup": 225
},
{
"id": "jvasp-54689",
"created_at": "2022-09-04T14:37:47.614390Z",
"updated_at": "2022-09-04T14:37:47.614409Z",
"structure_string": "H4 N4 O4\n1.0\n5.616989 0.000000 -2.659009\n-0.367209 3.002546 3.618493\n-0.367209 -3.002546 3.618493\nH N O\n4 4 4\ndirect\n-0.038892 0.273398 0.144279 H\n0.461108 0.144279 0.273397 H\n0.038891 0.726601 0.855719 H\n0.538891 0.855719 0.726601 H\n0.250000 0.605390 0.394609 N\n0.750000 0.394609 0.605389 N\n0.250000 0.805291 0.194708 N\n0.750000 0.194708 0.805291 N\n0.091133 0.301606 0.372395 O\n0.591133 0.372395 0.301606 O\n0.908867 0.698393 0.627603 O\n0.408867 0.627604 0.698393 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"H",
"N",
"O"
],
"chemical_system": "H-N-O",
"density": 1.7729549308831487,
"density_atomic": 0.10327887781086369,
"volume": 116.19026324023193,
"volume_molar": 5.830951001451086,
"formula_full": "H4 N4 O4",
"formula_reduced": "HNO",
"formula_anonymous": "ABC",
"energy_above_hull": 2.9749022499999995,
"spacegroup": 15
},
{
"id": "jvasp-39412",
"created_at": "2022-09-04T14:37:47.625451Z",
"updated_at": "2022-09-04T14:37:47.625472Z",
"structure_string": "Lu2 Ga1 Cu1\n1.0\n0.000014 3.431553 3.431545\n3.431544 0.000025 3.431533\n3.431536 3.431534 0.000033\nLu Ga Cu\n2 1 1\ndirect\n0.000001 0.000001 0.999996 Lu\n0.499996 0.500003 0.500000 Lu\n0.749996 0.750000 0.750000 Ga\n0.250002 0.249996 0.250003 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Ga",
"Cu"
],
"chemical_system": "Cu-Ga-Lu",
"density": 9.928548614025464,
"density_atomic": 0.04949565074457467,
"volume": 80.81518153266121,
"volume_molar": 12.167009968365958,
"formula_full": "Lu2 Ga1 Cu1",
"formula_reduced": "Lu2GaCu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.374503696875,
"spacegroup": 225
},
{
"id": "jvasp-39668",
"created_at": "2022-09-04T14:37:47.648726Z",
"updated_at": "2022-09-04T14:37:47.648753Z",
"structure_string": "Li2 Tl1 Ag1\n1.0\n-0.000000 3.280837 3.280837\n3.280837 -0.000000 3.280837\n3.280837 3.280837 0.000000\nLi Tl Ag\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.750000 0.750000 0.750000 Tl\n0.249999 0.249999 0.249999 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Tl",
"Ag"
],
"chemical_system": "Ag-Li-Tl",
"density": 7.667619456263828,
"density_atomic": 0.05663384310497718,
"volume": 70.62914647317066,
"volume_molar": 10.633466545502284,
"formula_full": "Li2 Tl1 Ag1",
"formula_reduced": "Li2TlAg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.057154965,
"spacegroup": 225
},
{
"id": "jvasp-39781",
"created_at": "2022-09-04T14:37:47.926913Z",
"updated_at": "2022-09-04T14:37:47.926934Z",
"structure_string": "Na1 Yb1 Au2\n1.0\n-0.000000 3.505366 3.505366\n3.505366 -0.000000 3.505366\n3.505366 3.505366 -0.000000\nYb Na Au\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Yb\n0.250001 0.250001 0.250001 Na\n0.000000 0.000000 0.000000 Au\n0.500001 0.500001 0.500001 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Na",
"Au"
],
"chemical_system": "Au-Na-Yb",
"density": 11.37217931805586,
"density_atomic": 0.04643333591307074,
"volume": 86.14500598209273,
"volume_molar": 12.96943379488011,
"formula_full": "Na1 Yb1 Au2",
"formula_reduced": "NaYbAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-38292",
"created_at": "2022-09-04T14:37:47.656122Z",
"updated_at": "2022-09-04T14:37:47.656135Z",
"structure_string": "Rb1 Ru1 O3\n1.0\n3.952619 -0.000000 0.000000\n-0.000000 3.952619 0.000000\n-0.000000 -0.000000 3.952619\nRb Ru O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 Ru\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Ru",
"O"
],
"chemical_system": "O-Rb-Ru",
"density": 6.306722899138126,
"density_atomic": 0.08096832265846211,
"volume": 61.75254514152199,
"volume_molar": 7.4376503826099905,
"formula_full": "Rb1 Ru1 O3",
"formula_reduced": "RbRuO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.0392182,
"spacegroup": 221
},
{
"id": "jvasp-38555",
"created_at": "2022-09-04T14:37:47.656211Z",
"updated_at": "2022-09-04T14:37:47.656237Z",
"structure_string": "Li2 Ac1 Tl1\n1.0\n-0.000000 3.646357 3.646357\n3.646357 0.000000 3.646357\n3.646357 3.646357 0.000000\nLi Ac Tl\n2 1 1\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.250000 Ac\n0.750001 0.750001 0.750001 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ac",
"Tl"
],
"chemical_system": "Ac-Li-Tl",
"density": 7.625360738518988,
"density_atomic": 0.04125270550299627,
"volume": 96.96333734303734,
"volume_molar": 14.598171650978381,
"formula_full": "Li2 Ac1 Tl1",
"formula_reduced": "Li2AcTl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.34025,
"spacegroup": 225
},
{
"id": "jvasp-40230",
"created_at": "2022-09-04T14:37:47.660971Z",
"updated_at": "2022-09-04T14:37:47.661003Z",
"structure_string": "Be1 Ga1 Ir2\n1.0\n-0.000000 2.944353 2.944353\n2.944353 -0.000000 2.944353\n2.944353 2.944353 -0.000000\nBe Ga Ir\n1 1 2\ndirect\n0.250001 0.250001 0.250001 Be\n0.749999 0.749999 0.749999 Ga\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.500000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ga",
"Ir"
],
"chemical_system": "Be-Ga-Ir",
"density": 15.06569347216293,
"density_atomic": 0.07835385452543504,
"volume": 51.050455963229346,
"volume_molar": 7.685825791818712,
"formula_full": "Be1 Ga1 Ir2",
"formula_reduced": "BeGaIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.54121765625,
"spacegroup": 225
},
{
"id": "jvasp-39780",
"created_at": "2022-09-04T14:37:47.696572Z",
"updated_at": "2022-09-04T14:37:47.696595Z",
"structure_string": "Lu1 In1 Ag2\n1.0\n0.000000 3.443231 3.443231\n3.443231 -0.000000 3.443231\n3.443231 3.443231 0.000000\nLu In Ag\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Lu\n0.250000 0.250000 0.250000 In\n0.499999 0.499999 0.499999 Ag\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"In",
"Ag"
],
"chemical_system": "Ag-In-Lu",
"density": 10.28158730925218,
"density_atomic": 0.048992716062222906,
"volume": 81.64478970547017,
"volume_molar": 12.29191039817351,
"formula_full": "Lu1 In1 Ag2",
"formula_reduced": "LuInAg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-36847",
"created_at": "2022-09-04T14:37:47.696903Z",
"updated_at": "2022-09-04T14:37:47.696931Z",
"structure_string": "Pb2 Au2 O4\n1.0\n3.672459 0.017274 0.004696\n0.090895 5.581135 0.064695\n0.896138 0.287230 6.831997\nPb Au O\n2 2 4\ndirect\n0.325393 0.507463 0.257028 Pb\n0.674609 0.492537 0.742974 Pb\n0.000000 0.000000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n0.217337 0.311320 0.564053 O\n0.886784 0.179878 0.248510 O\n0.113217 0.820122 0.751492 O\n0.782665 0.688680 0.435949 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Pb",
"Au",
"O"
],
"chemical_system": "Au-O-Pb",
"density": 10.351839014807807,
"density_atomic": 0.057171188841978686,
"volume": 139.93062173522438,
"volume_molar": 10.53352375904796,
"formula_full": "Pb2 Au2 O4",
"formula_reduced": "PbAuO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.1865938475000002,
"spacegroup": 2
}
]
}